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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC(=O)C=C(N2)CC(=O)NC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC(=O)C=C(N2)CC(=O)NC

InChI

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