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

Systemtic Name: N6-(4-butylphenyl)-N4-ethyl-N4-phenyl-pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butylphenyl)-N4-ethyl-N4-phenyl-pyrimidine-4,5,6-triamine CAS Name: N6-(4-butylphenyl)-N4-ethyl-N4-phenylpyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-butylphenyl)-4-N-ethyl-4-N-phenylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C22H27N5 MolecularWeight: 361.48328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5/c1-3-5-9-17-12-14-18(15-13-17)26-21-20(23)22(25-16-24-21)27(4-2)19-10-7-6-8-11-19/h6-8,10-16H,3-5,9,23H2,1-2H3,(H,24,25,26)