ethyl 2-[2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[[6-(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]thio]acetyl]amino]acetic acid ethyl ester Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C18H16ClN3O3S/c1-2-25-17(24)10-21-16(23)11-26-18-13(9-20)5-8-15(22-18)12-3-6-14(19)7-4-12/h3-8H,2,10-11H2,1H3,(H,21,23)