4-[2-(4-methoxyphenyl)-9-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(4-methoxyphenyl)-9-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(4-methoxyphenyl)-9-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(4-methoxyphenyl)-9-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(4-methoxyphenyl)-9-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[2-(4-methoxyphenyl)-9-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,5-dien-1-one Formula: C23H21NO2S MolecularWeight: 375.48334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC(=C3C=CC(=O)C=C3)CC(S2)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C(=CC=C1)NC(=C3C=CC(=O)C=C3)CC(S2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21NO2S/c1-15-4-3-5-20-23(15)27-22(17-8-12-19(26-2)13-9-17)14-21(24-20)16-6-10-18(25)11-7-16/h3-13,22,24H,14H2,1-2H3