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

Systemtic Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(phenylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Openeye Name: N-benzyl-2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide CAS Name: 2-methyl-4-(4-methyl-1-piperazin-4-iumyl)-N-(phenylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide IUPAC Name: N-benzyl-2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Traditional Name: N-benzyl-2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-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:

CC1=NC2=C(CN(CC2)C(=O)NCC3=CC=CC=C3)C(=N1)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=NC2=C(CN(CC2)C(=O)NCC3=CC=CC=C3)C(=N1)N4CC[NH+](CC4)C

InChI

InChI=1S/C21H28N6O/c1-16-23-19-8-9-27(21(28)22-14-17-6-4-3-5-7-17)15-18(19)20(24-16)26-12-10-25(2)11-13-26/h3-7H,8-15H2,1-2H3,(H,22,28)/p+1