N6-butyl-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-butyl-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-butyl-N4-ethyl-N4-(m-tolyl)pyrimidine-4,5,6-triamine CAS Name: N6-butyl-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-butyl-4-N-ethyl-4-N-(3-methylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(butylamino)pyrimidin-4-yl]-ethyl-(m-tolyl)amine Formula: C17H25N5 MolecularWeight: 299.4139

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC=N1)N(CC)C2=CC=CC(=C2)C)N

Isomeric SMILES

CCCCNC1=C(C(=NC=N1)N(CC)C2=CC=CC(=C2)C)N

InChI

InChI=1S/C17H25N5/c1-4-6-10-19-16-15(18)17(21-12-20-16)22(5-2)14-9-7-8-13(3)11-14/h7-9,11-12H,4-6,10,18H2,1-3H3,(H,19,20,21)