| CAS Number | 316-07-4 |
| Catalog Number | AG01C4SC(AGN-PC-0R6ZDW) |
| Chemical Name | 2-chloro-10-[3-(dimethylamino)propyl]-10H-5lambda4-phenothiazin-5-one hydrochloride |
| IUPAC Name | 3-(2-chloro-5-oxophenothiazin-10-yl)-N,N-dimethylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C17H19ClN2OS.ClH/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)22(21)17-9-8-13(18)12-15(17)20;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H |
| InChI Key | VWLMLCOTJLYYST-UHFFFAOYSA-N |
| MDL Number | MFCD00798915 |
| Molecular Formula | C17H20Cl2N2OS |
| Molecular Weight | 371.3245 |
| NSC Number | 17470 |
| SMILES | Cl.CN(CCCN1C2=C(C=CC(=C2)Cl)S(=O)C2=C1C=CC=C2)C |
| Synonyms | chlorpromazine sulfoxide,
opromazine,
opromazine hydrochloride,
316-07-4,
Chlorpromazine sulfoxide hydrochloride,
opromazine hydrochloride,
SCHEMBL9724483,
DTXSID00636606,
NSC17470,
NSC-17470,
2-chloro-10-[3-(dimethylamino)propyl]-10H-5lambda-phenothiazin-5-one hydrochloride,
2-Chloro-10-[3-(dimethylamino)propyl]-5lambda~4~-phenothiazin-5(10H)-one--hydrogen chloride (1/1),
3-(2-chloro-5-oxophenothiazin-10-yl)-N,N-dimethylpropan-1-am,
|
| Complexity | 406 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 370.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 371.32g/mol |
| Monoisotopic Mass | 370.067g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 53.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number