N-(phenylmethyl)-3-[(2-thiophen-2-ylsulfanylethanoylamino)carbamoyl]benzenesulfonamide

Systemtic Name: N-(phenylmethyl)-3-[(2-thiophen-2-ylsulfanylethanoylamino)carbamoyl]benzenesulfonamide Openeye Name: N-benzyl-3-[[[2-(2-thienylsulfanyl)acetyl]amino]carbamoyl]benzenesulfonamide CAS Name: 3-[oxo-[[1-oxo-2-(thiophen-2-ylthio)ethyl]hydrazo]methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[(2-thiophen-2-ylsulfanylacetyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[[2-(2-thienylthio)acetyl]amino]carbamoyl]benzenesulfonamide Formula: C20H19N3O4S3 MolecularWeight: 461.57756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CSC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CSC3=CC=CS3

InChI

InChI=1S/C20H19N3O4S3/c24-18(14-29-19-10-5-11-28-19)22-23-20(25)16-8-4-9-17(12-16)30(26,27)21-13-15-6-2-1-3-7-15/h1-12,21H,13-14H2,(H,22,24)(H,23,25)