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

Systemtic Name: N6-butyl-N4-(4-butylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-butyl-N4-(4-butylphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-butyl-N4-(4-butylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-butyl-4-N-(4-butylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(butylamino)pyrimidin-4-yl]-(4-butylphenyl)amine Formula: C18H27N5 MolecularWeight: 313.44048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCCC)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCCC)N

InChI

InChI=1S/C18H27N5/c1-3-5-7-14-8-10-15(11-9-14)23-18-16(19)17(21-13-22-18)20-12-6-4-2/h8-11,13H,3-7,12,19H2,1-2H3,(H2,20,21,22,23)