4-(azepan-1-yl)-5-methyl-N-(4-methylphenyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(azepan-1-yl)-5-methyl-N-(4-methylphenyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(azepan-1-yl)-5-methyl-N-(p-tolyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1-azepanyl)-5-methyl-N-(4-methylphenyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(azepan-1-yl)-5-methyl-N-(4-methylphenyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(azepan-1-yl)-5-methyl-N-(p-tolyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCCCCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCCCCC4)C

InChI

InChI=1S/C21H24N4OS/c1-14-7-9-16(10-8-14)24-20(26)18-15(2)17-19(22-13-23-21(17)27-18)25-11-5-3-4-6-12-25/h7-10,13H,3-6,11-12H2,1-2H3,(H,24,26)