N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-(2-pyrazol-1-ylpyridin-4-yl)methanamine

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-(2-pyrazol-1-ylpyridin-4-yl)methanamine Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-(2-pyrazol-1-yl-4-pyridyl)methanamine CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-[2-(1-pyrazolyl)-4-pyridinyl]methanamine IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-(2-pyrazol-1-ylpyridin-4-yl)methanamine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl-[(2-pyrazol-1-yl-4-pyridyl)methyl]amine Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNCC3=CC(=NC=C3)N4C=CC=N4

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNCC3=CC(=NC=C3)N4C=CC=N4

InChI

InChI=1S/C19H20N4O2/c1-4-16(19-17(5-1)24-10-3-11-25-19)14-20-13-15-6-8-21-18(12-15)23-9-2-7-22-23/h1-2,4-9,12,20H,3,10-11,13-14H2