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

Systemtic Name: 2-(1-cyclohexyl-5-ethyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]-N-(p-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=C(C=C2)C)C3CCCCC3)O

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)NC2=CC=C(C=C2)C)C3CCCCC3)O

InChI

InChI=1S/C21H27N3O3S/c1-3-17-19(26)23-21(24(20(17)27)16-7-5-4-6-8-16)28-13-18(25)22-15-11-9-14(2)10-12-15/h9-12,16,27H,3-8,13H2,1-2H3,(H,22,25)