3-acetamido-4-methyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)benzamide

Systemtic Name: 3-acetamido-4-methyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)benzamide Openeye Name: 3-acetamido-4-methyl-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)benzamide CAS Name: 3-acetamido-4-methyl-N-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)benzamide IUPAC Name: 3-acetamido-4-methyl-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)benzamide Traditional Name: 3-acetamido-N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)-4-methyl-benzamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3C)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3C)NC(=O)C

InChI

InChI=1S/C24H21N3O3S/c1-14-8-9-16(12-19(14)25-15(2)28)23(29)26-17-10-11-22-20(13-17)27(3)24(30)18-6-4-5-7-21(18)31-22/h4-13H,1-3H3,(H,25,28)(H,26,29)