1-(2,3-dihydro-1,4-benzodioxin-3-yl)-N-[[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methyl]methanamine

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-N-[[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methyl]methanamine Openeye Name: N-[[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyl]-1-(2,3-dihydro-1,4-benzodioxin-3-yl)methanamine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-N-[[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methyl]methanamine IUPAC Name: N-[(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methyl]-1-(2,3-dihydro-1,4-benzodioxin-3-yl)methanamine Traditional Name: [1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyl-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)amine Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNCC3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNCC3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N4O2/c1-2-7-19(8-3-1)16-29-17-21(25(28-29)20-9-6-12-26-13-20)14-27-15-22-18-30-23-10-4-5-11-24(23)31-22/h1-13,17,22,27H,14-16,18H2