2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]ethyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]ethyl]pyrimidine-4,6-diamine Openeye Name: 2-[2-[[1-[(3,4-dichlorophenyl)methyl]-4-piperidyl]amino]ethyl]pyrimidine-4,6-diamine CAS Name: 2-[2-[[1-[(3,4-dichlorophenyl)methyl]-4-piperidinyl]amino]ethyl]pyrimidine-4,6-diamine IUPAC Name: 2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]ethyl]pyrimidine-4,6-diamine Traditional Name: 2-(4,6-diaminopyrimidin-2-yl)ethyl-[1-(3,4-dichlorobenzyl)-4-piperidyl]amine Formula: C18H24Cl2N6 MolecularWeight: 395.32936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCC2=NC(=CC(=N2)N)N)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCC1NCCC2=NC(=CC(=N2)N)N)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H24Cl2N6/c19-14-2-1-12(9-15(14)20)11-26-7-4-13(5-8-26)23-6-3-18-24-16(21)10-17(22)25-18/h1-2,9-10,13,23H,3-8,11H2,(H4,21,22,24,25)