N-(2,3-dimethylcyclohexyl)-2-[6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-2-[6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,3-dimethylcyclohexyl)-2-[6-ethyl-5-methyl-4-oxo-3-(p-tolylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(2,3-dimethylcyclohexyl)-2-[[6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-2-[6-ethyl-5-methyl-3-[(4-methylphenyl)methyl]-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(2,3-dimethylcyclohexyl)-2-[[6-ethyl-4-keto-5-methyl-3-(4-methylbenzyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C27H35N3O2S2 MolecularWeight: 497.7157

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)C)SCC(=O)NC4CCCC(C4C)C)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)C)SCC(=O)NC4CCCC(C4C)C)C

InChI

InChI=1S/C27H35N3O2S2/c1-6-22-19(5)24-25(34-22)29-27(30(26(24)32)14-20-12-10-16(2)11-13-20)33-15-23(31)28-21-9-7-8-17(3)18(21)4/h10-13,17-18,21H,6-9,14-15H2,1-5H3,(H,28,31)