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

Systemtic Name: N-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Openeye Name: N-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide CAS Name: N-ethyl-4-(4-methyl-1-piperazin-4-iumyl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide IUPAC Name: N-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Traditional Name: N-ethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Formula: C21H29N6O+ MolecularWeight: 381.49456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N6O/c1-3-22-21(28)27-10-9-18-17(15-27)20(26-13-11-25(2)12-14-26)24-19(23-18)16-7-5-4-6-8-16/h4-8H,3,9-15H2,1-2H3,(H,22,28)/p+1