N-(2-dimethylaminoethyl)-5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-5-methyl-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-5-methyl-6-oxobenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-6-keto-5-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NCCN(C)C)SC3=CC=CC=C3C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NCCN(C)C)SC3=CC=CC=C3C1=O

InChI

InChI=1S/C19H21N3O2S/c1-21(2)11-10-20-18(23)13-8-9-17-15(12-13)22(3)19(24)14-6-4-5-7-16(14)25-17/h4-9,12H,10-11H2,1-3H3,(H,20,23)