5-methoxy-6-[(2S)-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 5-methoxy-6-[(2S)-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 5-methoxy-6-[(2S)-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 5-methoxy-6-[(2S)-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 5-methoxy-6-[(2S)-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 5-methoxy-6-[(2S)-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C22H19NO2S MolecularWeight: 361.45676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=O)C1=C2CC(SC3=CC=CC=C3N2)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=O)C1=C2C[C@H](SC3=CC=CC=C3N2)C4=CC=CC=C4

InChI

InChI=1S/C22H19NO2S/c1-25-19-12-7-11-18(24)22(19)17-14-21(15-8-3-2-4-9-15)26-20-13-6-5-10-16(20)23-17/h2-13,21,23H,14H2,1H3/t21-/m0/s1