3-methoxy-N-[[4-(phenylmethyl)-5-(1-pyridin-2-ylpiperidin-4-yl)-1,2,4-triazol-3-yl]methyl]propan-1-amine

Systemtic Name: 3-methoxy-N-[[4-(phenylmethyl)-5-(1-pyridin-2-ylpiperidin-4-yl)-1,2,4-triazol-3-yl]methyl]propan-1-amine Openeye Name: N-[[4-benzyl-5-[1-(2-pyridyl)-4-piperidyl]-1,2,4-triazol-3-yl]methyl]-3-methoxy-propan-1-amine CAS Name: 3-methoxy-N-[[4-(phenylmethyl)-5-[1-(2-pyridinyl)-4-piperidinyl]-1,2,4-triazol-3-yl]methyl]-1-propanamine IUPAC Name: N-[[4-benzyl-5-(1-pyridin-2-ylpiperidin-4-yl)-1,2,4-triazol-3-yl]methyl]-3-methoxypropan-1-amine Traditional Name: [4-benzyl-5-[1-(2-pyridyl)-4-piperidyl]-1,2,4-triazol-3-yl]methyl-(3-methoxypropyl)amine Formula: C24H32N6O MolecularWeight: 420.55048

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNCC1=NN=C(N1CC2=CC=CC=C2)C3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COCCCNCC1=NN=C(N1CC2=CC=CC=C2)C3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C24H32N6O/c1-31-17-7-13-25-18-23-27-28-24(30(23)19-20-8-3-2-4-9-20)21-11-15-29(16-12-21)22-10-5-6-14-26-22/h2-6,8-10,14,21,25H,7,11-13,15-19H2,1H3