N4-(4-butylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine

Systemtic Name: N4-(4-butylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine Openeye Name: N4-(4-butylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine CAS Name: N4-(4-butylphenyl)-6-(4-methyl-1-piperazinyl)pyrimidine-4,5-diamine IUPAC Name: 4-N-(4-butylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-methylpiperazino)pyrimidin-4-yl]-(4-butylphenyl)amine Formula: C19H28N6 MolecularWeight: 340.46582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCN(CC3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCN(CC3)C

InChI

InChI=1S/C19H28N6/c1-3-4-5-15-6-8-16(9-7-15)23-18-17(20)19(22-14-21-18)25-12-10-24(2)11-13-25/h6-9,14H,3-5,10-13,20H2,1-2H3,(H,21,22,23)