2-[3-(4-methylphenyl)sulfonylpropanoylamino]-5-phenyl-thiophene-3-carboxamide

Systemtic Name: 2-[3-(4-methylphenyl)sulfonylpropanoylamino]-5-phenyl-thiophene-3-carboxamide Openeye Name: 5-phenyl-2-[3-(p-tolylsulfonyl)propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxamide IUPAC Name: 2-[3-(4-methylphenyl)sulfonylpropanoylamino]-5-phenylthiophene-3-carboxamide Traditional Name: 5-phenyl-2-(3-tosylpropanoylamino)thiophene-3-carboxamide Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H20N2O4S2/c1-14-7-9-16(10-8-14)29(26,27)12-11-19(24)23-21-17(20(22)25)13-18(28-21)15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H2,22,25)(H,23,24)