3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[(2-methylphenyl)methyl]propanamide

Systemtic Name: 3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[(2-methylphenyl)methyl]propanamide Openeye Name: 3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-N-(o-tolylmethyl)propanamide CAS Name: 3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]-N-[(2-methylphenyl)methyl]propanamide IUPAC Name: 3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-N-[(2-methylphenyl)methyl]propanamide Traditional Name: 3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]-N-(2-methylbenzyl)propionamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)CCC2=C(NC(=NC2=O)SC)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)CCC2=C(NC(=NC2=O)SC)C

InChI

InChI=1S/C17H21N3O2S/c1-11-6-4-5-7-13(11)10-18-15(21)9-8-14-12(2)19-17(23-3)20-16(14)22/h4-7H,8-10H2,1-3H3,(H,18,21)(H,19,20,22)