4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)cyclohexa-2,5-dien-1-one Formula: C21H17NOS MolecularWeight: 331.43078

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2NC1=C3C=CC(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(SC2=CC=CC=C2NC1=C3C=CC(=O)C=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17NOS/c23-17-12-10-15(11-13-17)19-14-21(16-6-2-1-3-7-16)24-20-9-5-4-8-18(20)22-19/h1-13,21-22H,14H2