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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)C(=O)NC3CC3)SC4=C1C=C(C=C4)C

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)C(=O)NC3CC3)SC4=C1C=C(C=C4)C

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/h5-6,9-12,15H,3-4,7-8H2,1-2H3,(H,22,24)