2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methoxy-3-sulfamoyl-phenyl)benzamide

Systemtic Name: 2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methoxy-3-sulfamoyl-phenyl)benzamide Openeye Name: 2-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanyl-N-(4-methoxy-3-sulfamoyl-phenyl)benzamide CAS Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]thio]-N-(4-methoxy-3-sulfamoylphenyl)benzamide IUPAC Name: 2-[2-(3-cyanoanilino)-2-oxoethyl]sulfanyl-N-(4-methoxy-3-sulfamoylphenyl)benzamide Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]-N-(4-methoxy-3-sulfamoyl-phenyl)benzamide Formula: C23H20N4O5S2 MolecularWeight: 496.5587

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC=CC(=C3)C#N)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC=CC(=C3)C#N)S(=O)(=O)N

InChI

InChI=1S/C23H20N4O5S2/c1-32-19-10-9-17(12-21(19)34(25,30)31)27-23(29)18-7-2-3-8-20(18)33-14-22(28)26-16-6-4-5-15(11-16)13-24/h2-12H,14H2,1H3,(H,26,28)(H,27,29)(H2,25,30,31)