N-cyclopropyl-8-methyl-6-propylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-cyclopropyl-8-methyl-6-propylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-cyclopropyl-8-methyl-6-propylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-cyclopropyl-8-methyl-6-propylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: N-cyclopropyl-8-methyl-6-propylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-cyclopropyl-8-methyl-6-propylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C1C2=C(C=CC(=C2)C)SC3=C(N1)C=C(C=C3)C(=O)NC4CC4

Isomeric SMILES

CCC=C1C2=C(C=CC(=C2)C)SC3=C(N1)C=C(C=C3)C(=O)NC4CC4

InChI

InChI=1S/C21H22N2OS/c1-3-4-17-16-11-13(2)5-9-19(16)25-20-10-6-14(12-18(20)23-17)21(24)22-15-7-8-15/h4-6,9-12,15,23H,3,7-8H2,1-2H3,(H,22,24)