2-(cyanomethylsulfanyl)-N-cyclohexyl-5-methyl-4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-cyclohexyl-5-methyl-4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-benzyl-2-(cyanomethylsulfanyl)-N-cyclohexyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-(cyanomethylthio)-N-cyclohexyl-5-methyl-4-oxo-3-(phenylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-benzyl-2-(cyanomethylsulfanyl)-N-cyclohexyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-benzyl-2-(cyanomethylthio)-N-cyclohexyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC#N)CC3=CC=CC=C3)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC#N)CC3=CC=CC=C3)C(=O)NC4CCCCC4

InChI

InChI=1S/C23H24N4O2S2/c1-15-18-21(31-19(15)20(28)25-17-10-6-3-7-11-17)26-23(30-13-12-24)27(22(18)29)14-16-8-4-2-5-9-16/h2,4-5,8-9,17H,3,6-7,10-11,13-14H2,1H3,(H,25,28)