3-[[(5-methyl-4-nitro-thiophen-2-yl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[(5-methyl-4-nitro-thiophen-2-yl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[(5-methyl-4-nitro-thiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: 3-[[[(5-methyl-4-nitro-2-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[(5-methyl-4-nitrothiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[(5-methyl-4-nitro-thiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C20H18N4O6S2 MolecularWeight: 474.51012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O6S2/c1-13-17(24(27)28)11-18(31-13)20(26)23-22-19(25)15-8-5-9-16(10-15)32(29,30)21-12-14-6-3-2-4-7-14/h2-11,21H,12H2,1H3,(H,22,25)(H,23,26)