2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]quinazolin-4-amine

Systemtic Name: 2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]quinazolin-4-amine Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)quinazolin-4-amine CAS Name: 2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-4-quinazolinamine IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)quinazolin-4-amine Traditional Name: [2-(4-benzylpiperazine-1,4-diium-1-yl)quinazolin-4-yl]amine Formula: C19H23N5+2 MolecularWeight: 321.41942

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C19H21N5/c20-18-16-8-4-5-9-17(16)21-19(22-18)24-12-10-23(11-13-24)14-15-6-2-1-3-7-15/h1-9H,10-14H2,(H2,20,21,22)/p+2