4-[[5-azanyl-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]methyl]benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]methyl]benzenesulfonamide Openeye Name: 4-[[5-amino-4-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]methyl]benzenesulfonamide CAS Name: 4-[[5-amino-4-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-oxo-2H-pyrrol-1-yl]methyl]benzenesulfonamide IUPAC Name: 4-[[5-amino-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]methyl]benzenesulfonamide Traditional Name: 4-[[2-amino-3-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-4-keto-2-pyrrolin-1-yl]methyl]benzenesulfonamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)CC4=CC=C(C=C4)S(=O)(=O)N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)CC4=CC=C(C=C4)S(=O)(=O)N)N)OC

InChI

InChI=1S/C22H22N4O5S2/c1-30-18-8-5-14(9-19(18)31-2)16-12-32-22(25-16)20-17(27)11-26(21(20)23)10-13-3-6-15(7-4-13)33(24,28)29/h3-9,12H,10-11,23H2,1-2H3,(H2,24,28,29)