N-(4-methoxyphenyl)-3-[[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-[[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]carbamoyl]benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-3-[[[4-oxo-4-(2-thienyl)butanoyl]amino]carbamoyl]benzenesulfonamide CAS Name: 3-[[(1,4-dioxo-4-thiophen-2-ylbutyl)hydrazo]-oxomethyl]-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-[[(4-oxo-4-thiophen-2-ylbutanoyl)amino]carbamoyl]benzenesulfonamide Traditional Name: 3-[[[4-keto-4-(2-thienyl)butanoyl]amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Formula: C22H21N3O6S2 MolecularWeight: 487.54864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C22H21N3O6S2/c1-31-17-9-7-16(8-10-17)25-33(29,30)18-5-2-4-15(14-18)22(28)24-23-21(27)12-11-19(26)20-6-3-13-32-20/h2-10,13-14,25H,11-12H2,1H3,(H,23,27)(H,24,28)