N4-(4-butylphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine

Systemtic Name: N4-(4-butylphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine Openeye Name: N4-(4-butylphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine CAS Name: N4-(4-butylphenyl)-6-[4-(4-methoxyphenyl)-1-piperazinyl]pyrimidine-4,5-diamine IUPAC Name: 4-N-(4-butylphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(4-methoxyphenyl)piperazino]pyrimidin-4-yl]-(4-butylphenyl)amine Formula: C25H32N6O MolecularWeight: 432.56118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H32N6O/c1-3-4-5-19-6-8-20(9-7-19)29-24-23(26)25(28-18-27-24)31-16-14-30(15-17-31)21-10-12-22(32-2)13-11-21/h6-13,18H,3-5,14-17,26H2,1-2H3,(H,27,28,29)