O-ethyl [1-[(6-chloranylpyridin-2-yl)-ethanoyl-amino]-5-cyano-pentan-3-yl]sulfanylmethanethioate

Systemtic Name: O-ethyl [1-[(6-chloranylpyridin-2-yl)-ethanoyl-amino]-5-cyano-pentan-3-yl]sulfanylmethanethioate Openeye Name: O-ethyl [1-[2-[acetyl-(6-chloro-2-pyridyl)amino]ethyl]-3-cyano-propyl]sulfanylmethanethioate CAS Name: [[1-[acetyl-(6-chloro-2-pyridinyl)amino]-5-cyanopentan-3-yl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [1-[acetyl-(6-chloropyridin-2-yl)amino]-5-cyanopentan-3-yl]sulfanylmethanethioate Traditional Name: [[1-[2-[acetyl-(6-chloro-2-pyridyl)amino]ethyl]-3-cyano-propyl]thio]methanethioic acid O-ethyl ester Formula: C16H20ClN3O2S2 MolecularWeight: 385.9319

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCC#N)CCN(C1=NC(=CC=C1)Cl)C(=O)C

Isomeric SMILES

CCOC(=S)SC(CCC#N)CCN(C1=NC(=CC=C1)Cl)C(=O)C

InChI

InChI=1S/C16H20ClN3O2S2/c1-3-22-16(23)24-13(6-5-10-18)9-11-20(12(2)21)15-8-4-7-14(17)19-15/h4,7-8,13H,3,5-6,9,11H2,1-2H3