6-methyl-N-[4-(4-methylpiperazin-1-ium-1-yl)butyl]quinazolin-4-amine

Systemtic Name: 6-methyl-N-[4-(4-methylpiperazin-1-ium-1-yl)butyl]quinazolin-4-amine Openeye Name: 6-methyl-N-[4-(4-methylpiperazin-1-ium-1-yl)butyl]quinazolin-4-amine CAS Name: 6-methyl-N-[4-(4-methyl-1-piperazin-1-iumyl)butyl]-4-quinazolinamine IUPAC Name: 6-methyl-N-[4-(4-methylpiperazin-1-ium-1-yl)butyl]quinazolin-4-amine Traditional Name: 4-(4-methylpiperazin-1-ium-1-yl)butyl-(6-methylquinazolin-4-yl)amine Formula: C18H28N5+ MolecularWeight: 314.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN=C2NCCCC[NH+]3CCN(CC3)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN=C2NCCCC[NH+]3CCN(CC3)C

InChI

InChI=1S/C18H27N5/c1-15-5-6-17-16(13-15)18(21-14-20-17)19-7-3-4-8-23-11-9-22(2)10-12-23/h5-6,13-14H,3-4,7-12H2,1-2H3,(H,19,20,21)/p+1