N6-(4-butylphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-butylphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butylphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-butylphenyl)-N4-(4-methyl-1-piperazinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-butylphenyl)-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-(4-methylpiperazino)amine Formula: C19H29N7 MolecularWeight: 355.48046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NN3CCN(CC3)C)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NN3CCN(CC3)C)N

InChI

InChI=1S/C19H29N7/c1-3-4-5-15-6-8-16(9-7-15)23-18-17(20)19(22-14-21-18)24-26-12-10-25(2)11-13-26/h6-9,14H,3-5,10-13,20H2,1-2H3,(H2,21,22,23,24)