N-[[2,4-bis(oxidanylidene)-1,3-thiazolidin-5-yl]methyl]-8-methoxy-6-oxidanyl-5-oxidanylidene-N-phenyl-1,2-dihydro-3-benzothiepine-2-carboxamide

Systemtic Name: N-[[2,4-bis(oxidanylidene)-1,3-thiazolidin-5-yl]methyl]-8-methoxy-6-oxidanyl-5-oxidanylidene-N-phenyl-1,2-dihydro-3-benzothiepine-2-carboxamide Openeye Name: N-[(2,4-dioxothiazolidin-5-yl)methyl]-6-hydroxy-8-methoxy-5-oxo-N-phenyl-1,2-dihydro-3-benzothiepine-2-carboxamide CAS Name: N-[(2,4-dioxo-5-thiazolidinyl)methyl]-6-hydroxy-8-methoxy-5-oxo-N-phenyl-1,2-dihydro-3-benzothiepin-2-carboxamide IUPAC Name: N-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]-6-hydroxy-8-methoxy-5-oxo-N-phenyl-1,2-dihydro-3-benzothiepine-2-carboxamide Traditional Name: N-[(2,4-diketothiazolidin-5-yl)methyl]-6-hydroxy-5-keto-8-methoxy-N-phenyl-1,2-dihydro-3-benzothiepin-2-carboxamide Formula: C22H20N2O6S2 MolecularWeight: 472.534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)CC(SCC2=O)C(=O)N(CC3C(=O)NC(=O)S3)C4=CC=CC=C4)O

Isomeric SMILES

COC1=CC(=C2C(=C1)CC(SCC2=O)C(=O)N(CC3C(=O)NC(=O)S3)C4=CC=CC=C4)O

InChI

InChI=1S/C22H20N2O6S2/c1-30-14-7-12-8-17(31-11-16(26)19(12)15(25)9-14)21(28)24(13-5-3-2-4-6-13)10-18-20(27)23-22(29)32-18/h2-7,9,17-18,25H,8,10-11H2,1H3,(H,23,27,29)