N6-(4-butylphenyl)-N4,N4-bis(phenylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-butylphenyl)-N4,N4-bis(phenylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4,N4-dibenzyl-N6-(4-butylphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-butylphenyl)-N4,N4-bis(phenylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N,4-N-dibenzyl-6-N-(4-butylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-dibenzyl-amine Formula: C28H31N5 MolecularWeight: 437.57924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)N

InChI

InChI=1S/C28H31N5/c1-2-3-10-22-15-17-25(18-16-22)32-27-26(29)28(31-21-30-27)33(19-23-11-6-4-7-12-23)20-24-13-8-5-9-14-24/h4-9,11-18,21H,2-3,10,19-20,29H2,1H3,(H,30,31,32)