2-(1-cyclohexyl-5-ethyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-(1-cyclohexyl-5-ethyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-N-(2-methylphenyl)ethanamide Openeye Name: 2-(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-N-(o-tolyl)acetamide CAS Name: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanyl-N-(2-methylphenyl)acetamide Traditional Name: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]-N-(o-tolyl)acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=CC=CC=C2C)C3CCCCC3)O

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=CC=CC=C2C)C3CCCCC3)O

InChI

InChI=1S/C21H27N3O3S/c1-3-16-19(26)23-21(24(20(16)27)15-10-5-4-6-11-15)28-13-18(25)22-17-12-8-7-9-14(17)2/h7-9,12,15,27H,3-6,10-11,13H2,1-2H3,(H,22,25)