N-(2,6-dimethylphenyl)propanamide; 5-methyl-1-(4-methylphenyl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: N-(2,6-dimethylphenyl)propanamide; 5-methyl-1-(4-methylphenyl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: N-(2,6-dimethylphenyl)propanamide; 6-hydroxy-5-methyl-1-(p-tolyl)-2-thioxo-pyrimidin-4-one CAS Name: N-(2,6-dimethylphenyl)propanamide; 6-hydroxy-5-methyl-1-(4-methylphenyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: N-(2,6-dimethylphenyl)propanamide; 6-hydroxy-5-methyl-1-(4-methylphenyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: N-(2,6-dimethylphenyl)propionamide; 6-hydroxy-5-methyl-1-(p-tolyl)-2-thioxo-pyrimidin-4-one Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC=C1C)C.CC1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C)O

Isomeric SMILES

CCC(=O)NC1=C(C=CC=C1C)C.CC1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C)O

InChI

InChI=1S/C12H12N2O2S.C11H15NO/c1-7-3-5-9(6-4-7)14-11(16)8(2)10(15)13-12(14)17;1-4-10(13)12-11-8(2)6-5-7-9(11)3/h3-6,16H,1-2H3,(H,13,15,17);5-7H,4H2,1-3H3,(H,12,13)