N-methyl-2-[4-(phenylmethyl)sulfonylbutanoylamino]thiophene-3-carboxamide

Systemtic Name: N-methyl-2-[4-(phenylmethyl)sulfonylbutanoylamino]thiophene-3-carboxamide Openeye Name: 2-(4-benzylsulfonylbutanoylamino)-N-methyl-thiophene-3-carboxamide CAS Name: N-methyl-2-[[1-oxo-4-(phenylmethyl)sulfonylbutyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-(4-benzylsulfonylbutanoylamino)-N-methylthiophene-3-carboxamide Traditional Name: 2-(4-benzylsulfonylbutanoylamino)-N-methyl-thiophene-3-carboxamide Formula: C17H20N2O4S2 MolecularWeight: 380.4817

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(SC=C1)NC(=O)CCCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CNC(=O)C1=C(SC=C1)NC(=O)CCCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O4S2/c1-18-16(21)14-9-10-24-17(14)19-15(20)8-5-11-25(22,23)12-13-6-3-2-4-7-13/h2-4,6-7,9-10H,5,8,11-12H2,1H3,(H,18,21)(H,19,20)