6-piperidin-4-yl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]pyrimidin-4-amine

Systemtic Name: 6-piperidin-4-yl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]pyrimidin-4-amine Openeye Name: 6-(4-piperidyl)-N-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methyl]pyrimidin-4-amine CAS Name: 6-(4-piperidinyl)-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]-4-pyrimidinamine IUPAC Name: 6-piperidin-4-yl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]pyrimidin-4-amine Traditional Name: [6-(4-piperidyl)pyrimidin-4-yl]-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methyl]amine Formula: C17H20N8 MolecularWeight: 336.3943

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=CC(=NC=N2)NCC3=NC(=NN3)C4=CC=NC=C4

Isomeric SMILES

C1CNCCC1C2=CC(=NC=N2)NCC3=NC(=NN3)C4=CC=NC=C4

InChI

InChI=1S/C17H20N8/c1-5-18-6-2-12(1)14-9-15(22-11-21-14)20-10-16-23-17(25-24-16)13-3-7-19-8-4-13/h3-4,7-9,11-12,18H,1-2,5-6,10H2,(H,20,21,22)(H,23,24,25)