4-cyclopropyl-N-(4-dimethylaminophenyl)-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide

Systemtic Name: 4-cyclopropyl-N-(4-dimethylaminophenyl)-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide Openeye Name: 4-cyclopropyl-N-(4-dimethylaminophenyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide CAS Name: 4-cyclopropyl-N-(4-dimethylaminophenyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide IUPAC Name: 4-cyclopropyl-N-(4-dimethylaminophenyl)-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide Traditional Name: 4-cyclopropyl-N-(4-dimethylaminophenyl)-5-keto-3-methyl-2H-1,4-benzothiazepine-3-carboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=CC=CC=C2C(=O)N1C3CC3)C(=O)NC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1(CSC2=CC=CC=C2C(=O)N1C3CC3)C(=O)NC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C22H25N3O2S/c1-22(21(27)23-15-8-10-16(11-9-15)24(2)3)14-28-19-7-5-4-6-18(19)20(26)25(22)17-12-13-17/h4-11,17H,12-14H2,1-3H3,(H,23,27)