N-[(1S)-1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-[(1S)-1-(2-chlorophenyl)-2-oxo-cyclohexyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[(1S)-1-(2-chlorophenyl)-2-oxocyclohexyl]-N-methyl-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-[(1S)-1-(2-chlorophenyl)-2-oxocyclohexyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-[(1S)-1-(2-chlorophenyl)-2-keto-cyclohexyl]-N-methyl-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C21H20ClN3O2S2 MolecularWeight: 445.9854

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NC=NC2=C1C=CS2)C3(CCCCC3=O)C4=CC=CC=C4Cl

Isomeric SMILES

CN(C(=O)CSC1=NC=NC2=C1C=CS2)[C@@]3(CCCCC3=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H20ClN3O2S2/c1-25(18(27)12-29-20-14-9-11-28-19(14)23-13-24-20)21(10-5-4-8-17(21)26)15-6-2-3-7-16(15)22/h2-3,6-7,9,11,13H,4-5,8,10,12H2,1H3/t21-/m0/s1