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

Systemtic Name: N6-(4-butoxyphenyl)-N4-tert-butyl-pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butoxyphenyl)-N4-tert-butyl-pyrimidine-4,5,6-triamine CAS Name: N6-(4-butoxyphenyl)-N4-tert-butylpyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-butoxyphenyl)-4-N-tert-butylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butoxyanilino)pyrimidin-4-yl]-tert-butyl-amine Formula: C18H27N5O MolecularWeight: 329.43988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC(C)(C)C)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC(C)(C)C)N

InChI

InChI=1S/C18H27N5O/c1-5-6-11-24-14-9-7-13(8-10-14)22-16-15(19)17(21-12-20-16)23-18(2,3)4/h7-10,12H,5-6,11,19H2,1-4H3,(H2,20,21,22,23)