N6-(2-ethylphenyl)-N4,N4-bis(2-methylpropyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(2-ethylphenyl)-N4,N4-bis(2-methylpropyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(2-ethylphenyl)-N4,N4-diisobutyl-pyrimidine-4,5,6-triamine CAS Name: N6-(2-ethylphenyl)-N4,N4-bis(2-methylpropyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(2-ethylphenyl)-4-N,4-N-bis(2-methylpropyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(2-ethylanilino)pyrimidin-4-yl]-diisobutyl-amine Formula: C20H31N5 MolecularWeight: 341.49364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)N(CC(C)C)CC(C)C)N

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)N(CC(C)C)CC(C)C)N

InChI

InChI=1S/C20H31N5/c1-6-16-9-7-8-10-17(16)24-19-18(21)20(23-13-22-19)25(11-14(2)3)12-15(4)5/h7-10,13-15H,6,11-12,21H2,1-5H3,(H,22,23,24)