5-[2-(3-acetamidophenyl)sulfanylbutanoylamino]-4-cyano-3-methyl-N-phenyl-thiophene-2-carboxamide

Systemtic Name: 5-[2-(3-acetamidophenyl)sulfanylbutanoylamino]-4-cyano-3-methyl-N-phenyl-thiophene-2-carboxamide Openeye Name: 5-[2-(3-acetamidophenyl)sulfanylbutanoylamino]-4-cyano-3-methyl-N-phenyl-thiophene-2-carboxamide CAS Name: 5-[[2-[(3-acetamidophenyl)thio]-1-oxobutyl]amino]-4-cyano-3-methyl-N-phenyl-2-thiophenecarboxamide IUPAC Name: 5-[2-(3-acetamidophenyl)sulfanylbutanoylamino]-4-cyano-3-methyl-N-phenylthiophene-2-carboxamide Traditional Name: 5-[2-[(3-acetamidophenyl)thio]butanoylamino]-4-cyano-3-methyl-N-phenyl-thiophene-2-carboxamide Formula: C25H24N4O3S2 MolecularWeight: 492.61306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC=C2)C)C#N)SC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC=C2)C)C#N)SC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C25H24N4O3S2/c1-4-21(33-19-12-8-11-18(13-19)27-16(3)30)23(31)29-25-20(14-26)15(2)22(34-25)24(32)28-17-9-6-5-7-10-17/h5-13,21H,4H2,1-3H3,(H,27,30)(H,28,32)(H,29,31)