(5Z)-1-[(4-chlorophenyl)methyl]-5-[[(4-methylsulfanylphenyl)amino]-oxidanyl-methylidene]-2,2-bis(oxidanylidene)-2$l^{6},1-benzothiazepin-4-one

Systemtic Name: (5Z)-1-[(4-chlorophenyl)methyl]-5-[[(4-methylsulfanylphenyl)amino]-oxidanyl-methylidene]-2,2-bis(oxidanylidene)-2$l^{6},1-benzothiazepin-4-one Openeye Name: (5Z)-1-[(4-chlorophenyl)methyl]-5-[hydroxy-(4-methylsulfanylanilino)methylene]-2,2-dioxo-2$l^{6},1-benzothiazepin-4-one CAS Name: (5Z)-1-[(4-chlorophenyl)methyl]-5-[hydroxy-[4-(methylthio)anilino]methylidene]-2,2-dioxo-2$l^{6},1-benzothiazepin-4-one IUPAC Name: (5Z)-1-[(4-chlorophenyl)methyl]-5-[hydroxy-(4-methylsulfanylanilino)methylidene]-2,2-dioxo-2$l^{6},1-benzothiazepin-4-one Traditional Name: (5Z)-1-(4-chlorobenzyl)-5-[hydroxy-[4-(methylthio)anilino]methylene]-2,2-diketo-2$l^{6},1-benzothiazepin-4-one Formula: C24H21ClN2O4S2 MolecularWeight: 501.01754

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=C2C(=O)CS(=O)(=O)N(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl)O

Isomeric SMILES

CSC1=CC=C(C=C1)N/C(=C\2/C(=O)CS(=O)(=O)N(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl)/O

InChI

InChI=1S/C24H21ClN2O4S2/c1-32-19-12-10-18(11-13-19)26-24(29)23-20-4-2-3-5-21(20)27(33(30,31)15-22(23)28)14-16-6-8-17(25)9-7-16/h2-13,26,29H,14-15H2,1H3/b24-23-