N-[(4-chlorophenyl)methyl]-2-[6-methyl-4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[6-methyl-4-oxidanylidene-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[6-methyl-4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[6-methyl-4-oxo-2-(1-phenylethylthio)-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[6-methyl-4-oxo-2-(1-phenylethylsulfanyl)-1H-pyrimidin-5-yl]acetamide Traditional Name: N-(4-chlorobenzyl)-2-[4-keto-6-methyl-2-(1-phenylethylthio)-1H-pyrimidin-5-yl]acetamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(C)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC(C)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClN3O2S/c1-14-19(12-20(27)24-13-16-8-10-18(23)11-9-16)21(28)26-22(25-14)29-15(2)17-6-4-3-5-7-17/h3-11,15H,12-13H2,1-2H3,(H,24,27)(H,25,26,28)