2-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]propanoylamino]thiophene-3-carboxamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SC(C)C(=O)NC2=C(C=CS2)C(=O)N)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SC(C)C(=O)NC2=C(C=CS2)C(=O)N)C#N)C(=O)C

InChI

InChI=1S/C17H16N4O3S2/c1-8-13(9(2)22)6-11(7-18)16(20-8)26-10(3)15(24)21-17-12(14(19)23)4-5-25-17/h4-6,10H,1-3H3,(H2,19,23)(H,21,24)