4-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]acetyl]amino]benzamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C#N)C(=O)C

InChI

InChI=1S/C18H16N4O3S/c1-10-15(11(2)23)7-13(8-19)18(21-10)26-9-16(24)22-14-5-3-12(4-6-14)17(20)25/h3-7H,9H2,1-2H3,(H2,20,25)(H,22,24)