2-(4-methoxyphenyl)-8-phenylsulfanyl-5H-1,5-benzothiazepin-4-one

Systemtic Name: 2-(4-methoxyphenyl)-8-phenylsulfanyl-5H-1,5-benzothiazepin-4-one Openeye Name: 2-(4-methoxyphenyl)-8-phenylsulfanyl-5H-1,5-benzothiazepin-4-one CAS Name: 2-(4-methoxyphenyl)-8-(phenylthio)-5H-1,5-benzothiazepin-4-one IUPAC Name: 2-(4-methoxyphenyl)-8-phenylsulfanyl-5H-1,5-benzothiazepin-4-one Traditional Name: 2-(4-methoxyphenyl)-8-(phenylthio)-5H-1,5-benzothiazepin-4-one Formula: C22H17NO2S2 MolecularWeight: 391.50588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)NC3=C(S2)C=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)NC3=C(S2)C=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C22H17NO2S2/c1-25-16-9-7-15(8-10-16)20-14-22(24)23-19-12-11-18(13-21(19)27-20)26-17-5-3-2-4-6-17/h2-14H,1H3,(H,23,24)