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

Systemtic Name: 2-(1-cyclohexyl-5-ethyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-(1-cyclohexyl-5-ethyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(1-cyclohexyl-5-ethyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]-N-(4-methoxyphenyl)acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-3-17-19(26)23-21(24(20(17)27)15-7-5-4-6-8-15)29-13-18(25)22-14-9-11-16(28-2)12-10-14/h9-12,15,27H,3-8,13H2,1-2H3,(H,22,25)