N4-[(4-tert-butylphenyl)methyl]-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine

Systemtic Name: N4-[(4-tert-butylphenyl)methyl]-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine Openeye Name: N4-[(4-tert-butylphenyl)methyl]-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine CAS Name: N4-[(4-tert-butylphenyl)methyl]-6-(4-methyl-1-piperazinyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-[(4-tert-butylphenyl)methyl]-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(4-methylpiperazino)pyrimidin-4-yl]-(4-tert-butylbenzyl)amine Formula: C20H30N6 MolecularWeight: 354.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC2=NC(=NC(=C2)N3CCN(CC3)C)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC2=NC(=NC(=C2)N3CCN(CC3)C)N

InChI

InChI=1S/C20H30N6/c1-20(2,3)16-7-5-15(6-8-16)14-22-17-13-18(24-19(21)23-17)26-11-9-25(4)10-12-26/h5-8,13H,9-12,14H2,1-4H3,(H3,21,22,23,24)