N-tert-butyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-tert-butyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Openeye Name: N-tert-butyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide CAS Name: N-tert-butyl-4-(4-methyl-1-piperazin-4-iumyl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide IUPAC Name: N-tert-butyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Traditional Name: N-tert-butyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Formula: C23H33N6O+ MolecularWeight: 409.54772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC(C)(C)NC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C23H32N6O/c1-23(2,3)26-22(30)29-11-10-19-18(16-29)21(28-14-12-27(4)13-15-28)25-20(24-19)17-8-6-5-7-9-17/h5-9H,10-16H2,1-4H3,(H,26,30)/p+1