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

Systemtic Name: 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-N-[(1S)-1-(2-methylphenyl)ethyl]propanamide Openeye Name: 3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)-N-[(1S)-1-(o-tolyl)ethyl]propanamide CAS Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-N-[(1S)-1-(2-methylphenyl)ethyl]propanamide IUPAC Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-N-[(1S)-1-(2-methylphenyl)ethyl]propanamide Traditional Name: 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)-N-[(1S)-1-(o-tolyl)ethyl]propionamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC(=O)CCC2=C(NC(=S)NC2=O)C

Isomeric SMILES

CC1=CC=CC=C1[C@H](C)NC(=O)CCC2=C(NC(=S)NC2=O)C

InChI

InChI=1S/C17H21N3O2S/c1-10-6-4-5-7-13(10)11(2)18-15(21)9-8-14-12(3)19-17(23)20-16(14)22/h4-7,11H,8-9H2,1-3H3,(H,18,21)(H2,19,20,22,23)/t11-/m0/s1