N-cycloheptyl-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-cycloheptyl-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-cycloheptyl-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-cycloheptyl-2,5-dimethyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-cycloheptyl-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-cycloheptyl-2,5-dimethyl-4-(4-methylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H31N5OS MolecularWeight: 401.56874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C)C)C(=O)NC4CCCCCC4

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C)C)C(=O)NC4CCCCCC4

InChI

InChI=1S/C21H31N5OS/c1-14-17-19(26-12-10-25(3)11-13-26)22-15(2)23-21(17)28-18(14)20(27)24-16-8-6-4-5-7-9-16/h16H,4-13H2,1-3H3,(H,24,27)