N-(2-methylphenyl)-2-[[5-(2-methylpropyl)-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methylphenyl)-2-[[5-(2-methylpropyl)-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[(4-hydroxy-5-isobutyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(o-tolyl)acetamide CAS Name: 2-[[4-hydroxy-5-(2-methylpropyl)-6-oxo-1H-pyrimidin-2-yl]thio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[[4-hydroxy-5-(2-methylpropyl)-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[(4-hydroxy-5-isobutyl-6-keto-1H-pyrimidin-2-yl)thio]-N-(o-tolyl)acetamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC(=C(C(=O)N2)CC(C)C)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC(=C(C(=O)N2)CC(C)C)O

InChI

InChI=1S/C17H21N3O3S/c1-10(2)8-12-15(22)19-17(20-16(12)23)24-9-14(21)18-13-7-5-4-6-11(13)3/h4-7,10H,8-9H2,1-3H3,(H,18,21)(H2,19,20,22,23)