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AG003AU3

1802220-02-5 | 1,15-Etheno-1H-pyrazolo[4,3-f][1,4,8,10]benzoxatriazacyclotridecin-4(5H)-one,11-fluoro-6,7,13,14-tetrahydro-7,13-dimethyl-, (7S,13R)-

Chemical structure of 1,15-Etheno-1H-pyrazolo[4,3-f][1,4,8,10]benzoxatriazacyclotridecin-4(5H)-one,11-fluoro-6,7,13,14-tetrahydro-7,13-dimethyl-, (7S,13R)-, CAS 1802220-02-5
AG003AU3
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CAS Number 1802220-02-5
Catalog Number AG003AU3
Chemical Name 1,15-Etheno-1H-pyrazolo[4,3-f][1,4,8,10]benzoxatriazacyclotridecin-4(5H)-one,11-fluoro-6,7,13,14-tetrahydro-7,13-dimethyl-, (7S,13R)-
IUPAC Name (3R,11S)-6-fluoro-3,11-dimethyl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaen-14-one
InChI InChI=1S/C18H18FN5O2/c1-10-8-20-18(25)14-9-21-24-6-5-16(23-17(14)24)22-11(2)13-7-12(19)3-4-15(13)26-10/h3-7,9-11H,8H2,1-2H3,(H,20,25)(H,22,23)/t10-,11+/m0/s1
InChI Key FIKPXCOQUIZNHB-WDEREUQCSA-N
MDL Number MFCD31544350
Molecular Formula C18H18FN5O2
Molecular Weight 355.3662
SMILES O=C2NC[C@H](C)OC1=CC=C(F)C=C1[C@@H](C)NC4=NC3=C2C=NN3C=C4
UNII 08O3FQ4UNP
Synonyms
TPX-0005, Repotrectinib, 08O3FQ4UNP, UNII-08O3FQ4UNP, 1802220-02-5, Repotrectinib [USAN], repotrectinib (proposed INN), Repotrectinib (TPX-0005), SCHEMBL16946804, GTPL10316, TPX0005, TPX 0005 [WHO-DD], EX-A2572, TRX-0005, s8583, CS-7628, example 93 [US20170334929A1], HY-103022, TPX-0005,2058227-19-1,TPX-0005,TPX 0005,TPX0005, (13E,14E,3R,6S)-45-fluoro-3,6-dimethyl-5-oxa-2,8-diaza-1(5,3)-pyrazolo[1,5-a]pyrimidina-4(1,2)-benzenacyclononaphan-9-one, (3R,11S)-6-fluoro-3,11-dimethyl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaen-14-one, 1,15-Etheno-1H-pyrazolo(4,3-F)(1,4,8,10)benzoxatriazacyclotridecin-4(5H)-one, 11-fluoro-6,7,13,14-tetrahydro-7,13-dimethyl-, (7S,13R)-, 1,15-Etheno-1H-pyrazolo[4,3-f][1,4,8,10]benzoxatriazacyclotridecin-4(5H)-one,11-fluoro-6,7,13,14-tetrahydro-7,13-dimethyl-, (7S,13R)-, NO,

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