3-(cyanomethyl)-5-methyl-N-(2-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-(cyanomethyl)-5-methyl-N-(2-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-(cyanomethyl)-5-methyl-N-(o-tolyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-(cyanomethyl)-5-methyl-N-(2-methylphenyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-(cyanomethyl)-5-methyl-N-(2-methylphenyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-(cyanomethyl)-4-keto-5-methyl-N-(o-tolyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC#N)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC#N)C

InChI

InChI=1S/C17H14N4O2S/c1-10-5-3-4-6-12(10)20-15(22)14-11(2)13-16(24-14)19-9-21(8-7-18)17(13)23/h3-6,9H,8H2,1-2H3,(H,20,22)