N-(3-chlorophenyl)-N-(2-cyanoethyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chlorophenyl)-N-(2-cyanoethyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-chlorophenyl)-N-(2-cyanoethyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(3-chlorophenyl)-N-(2-cyanoethyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(3-chlorophenyl)-N-(2-cyanoethyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(3-chlorophenyl)-N-(2-cyanoethyl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetamide Formula: C18H19ClN4O2S MolecularWeight: 390.88706

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)N(CCC#N)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N(CCC#N)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H19ClN4O2S/c1-2-5-14-11-16(24)22-18(21-14)26-12-17(25)23(9-4-8-20)15-7-3-6-13(19)10-15/h3,6-7,10-11H,2,4-5,9,12H2,1H3,(H,21,22,24)