6-[4-(diphenylmethyl)piperazin-1-yl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-1-yl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-(4-benzhydrylpiperazin-1-yl)-N4-(3-pyridylmethyl)pyrimidine-4,5-diamine CAS Name: 6-[4-(diphenylmethyl)-1-piperazinyl]-N4-(3-pyridinylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-(4-benzhydrylpiperazin-1-yl)-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-benzhydrylpiperazino)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C27H29N7 MolecularWeight: 451.56606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NCC3=CN=CC=C3)N)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCC3=CN=CC=C3)N)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N7/c28-24-26(30-19-21-8-7-13-29-18-21)31-20-32-27(24)34-16-14-33(15-17-34)25(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-13,18,20,25H,14-17,19,28H2,(H,30,31,32)