6-methyl-4-phenyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]quinazoline

Systemtic Name: 6-methyl-4-phenyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]quinazoline Openeye Name: 2-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-4-phenyl-quinazoline CAS Name: 6-methyl-4-phenyl-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]quinazoline IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-4-phenylquinazoline Traditional Name: 2-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-4-phenyl-quinazoline Formula: C26H27N4+ MolecularWeight: 395.51938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N4/c1-20-12-13-24-23(18-20)25(22-10-6-3-7-11-22)28-26(27-24)30-16-14-29(15-17-30)19-21-8-4-2-5-9-21/h2-13,18H,14-17,19H2,1H3/p+1