N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetamide Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2CCCC(C2C)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N[C@@H]2CCC[C@H]([C@@H]2C)C

InChI

InChI=1S/C17H27N3O2S/c1-4-6-13-9-15(21)20-17(18-13)23-10-16(22)19-14-8-5-7-11(2)12(14)3/h9,11-12,14H,4-8,10H2,1-3H3,(H,19,22)(H,18,20,21)/t11-,12+,14-/m1/s1