2-[[5-[(2,5-dimethylphenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[(2,5-dimethylphenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[(2,5-dimethylphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[(2,5-dimethylphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: 2-[[5-[(2,5-dimethylphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(2,5-dimethylbenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]thio]acetamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(NC(=NC2=O)SCC(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(NC(=NC2=O)SCC(=O)N)C

InChI

InChI=1S/C16H19N3O2S/c1-9-4-5-10(2)12(6-9)7-13-11(3)18-16(19-15(13)21)22-8-14(17)20/h4-6H,7-8H2,1-3H3,(H2,17,20)(H,18,19,21)