7-(4-methylphenyl)-N-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-(4-methylphenyl)-N-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(4-methylphenyl)-N-(4-methyl-1-piperazin-4-iumyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-methylphenyl)-N-(4-methylpiperazin-4-ium-1-yl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C24H27N6+ MolecularWeight: 399.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NN4CC[NH+](CC4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NN4CC[NH+](CC4)C)C5=CC=CC=C5

InChI

InChI=1S/C24H26N6/c1-18-8-10-20(11-9-18)30-16-21(19-6-4-3-5-7-19)22-23(25-17-26-24(22)30)27-29-14-12-28(2)13-15-29/h3-11,16-17H,12-15H2,1-2H3,(H,25,26,27)/p+1