2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxidanylidene-pyrimidin-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxidanylidene-pyrimidin-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxo-pyrimidin-1-yl]-N-phenethyl-acetamide CAS Name: 2-[2-[(2-chlorophenyl)methylthio]-4-methyl-6-oxo-1-pyrimidinyl]-N-phenethylacetamide IUPAC Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxopyrimidin-1-yl]-N-phenethylacetamide Traditional Name: 2-[2-[(2-chlorobenzyl)thio]-6-keto-4-methyl-pyrimidin-1-yl]-N-phenethyl-acetamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2Cl)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2Cl)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H22ClN3O2S/c1-16-13-21(28)26(14-20(27)24-12-11-17-7-3-2-4-8-17)22(25-16)29-15-18-9-5-6-10-19(18)23/h2-10,13H,11-12,14-15H2,1H3,(H,24,27)