N2,N2,N4,N4,N6,5-hexakis(3-methylphenyl)pyrimidine-2,4,6-triamine

Systemtic Name: N2,N2,N4,N4,N6,5-hexakis(3-methylphenyl)pyrimidine-2,4,6-triamine Openeye Name: N2,N2,N4,N4,N6,5-hexakis(m-tolyl)pyrimidine-2,4,6-triamine CAS Name: N2,N2,N4,N4,N6,5-hexakis(3-methylphenyl)pyrimidine-2,4,6-triamine IUPAC Name: 2-N,2-N,4-N,4-N,6-N,5-hexakis(3-methylphenyl)pyrimidine-2,4,6-triamine Traditional Name: [2-[3-methyl-N-(m-tolyl)anilino]-6-(m-toluidino)-5-(m-tolyl)pyrimidin-4-yl]-bis(m-tolyl)amine Formula: C46H43N5 MolecularWeight: 665.86712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C(=NC(=N2)N(C3=CC=CC(=C3)C)C4=CC=CC(=C4)C)N(C5=CC=CC(=C5)C)C6=CC=CC(=C6)C)C7=CC(=CC=C7)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C(=NC(=N2)N(C3=CC=CC(=C3)C)C4=CC=CC(=C4)C)N(C5=CC=CC(=C5)C)C6=CC=CC(=C6)C)C7=CC(=CC=C7)C

InChI

InChI=1S/C46H43N5/c1-31-13-7-19-37(25-31)43-44(47-38-20-8-14-32(2)26-38)48-46(51(41-23-11-17-35(5)29-41)42-24-12-18-36(6)30-42)49-45(43)50(39-21-9-15-33(3)27-39)40-22-10-16-34(4)28-40/h7-30H,1-6H3,(H,47,48,49)