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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(N=C(NC1=O)SCC(=O)NC2=CC=CC=C2C)O

Isomeric SMILES

CC[C@H](C)C1=C(N=C(NC1=O)SCC(=O)NC2=CC=CC=C2C)O

InChI

InChI=1S/C17H21N3O3S/c1-4-10(2)14-15(22)19-17(20-16(14)23)24-9-13(21)18-12-8-6-5-7-11(12)3/h5-8,10H,4,9H2,1-3H3,(H,18,21)(H2,19,20,22,23)/t10-/m0/s1