6-[4-(diphenylmethyl)piperazin-1-yl]-N4-(4-ethylphenyl)pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-1-yl]-N4-(4-ethylphenyl)pyrimidine-4,5-diamine Openeye Name: 6-(4-benzhydrylpiperazin-1-yl)-N4-(4-ethylphenyl)pyrimidine-4,5-diamine CAS Name: 6-[4-(diphenylmethyl)-1-piperazinyl]-N4-(4-ethylphenyl)pyrimidine-4,5-diamine IUPAC Name: 6-(4-benzhydrylpiperazin-1-yl)-4-N-(4-ethylphenyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-benzhydrylpiperazino)pyrimidin-4-yl]-(4-ethylphenyl)amine Formula: C29H32N6 MolecularWeight: 464.60458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N6/c1-2-22-13-15-25(16-14-22)33-28-26(30)29(32-21-31-28)35-19-17-34(18-20-35)27(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-16,21,27H,2,17-20,30H2,1H3,(H,31,32,33)