N-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-2-(1-methylpyrazol-4-yl)ethanamine

Systemtic Name: N-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-2-(1-methylpyrazol-4-yl)ethanamine Openeye Name: N-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-2-(1-methylpyrazol-4-yl)ethanamine CAS Name: N-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-4-pyrazolyl]methyl]-2-(1-methyl-4-pyrazolyl)ethanamine IUPAC Name: N-[[3-(1,3-benzodioxol-5-yl)-1-phenylpyrazol-4-yl]methyl]-2-(1-methylpyrazol-4-yl)ethanamine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl-[2-(1-methylpyrazol-4-yl)ethyl]amine Formula: C23H23N5O2 MolecularWeight: 401.46102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CCNCC2=CN(N=C2C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CN1C=C(C=N1)CCNCC2=CN(N=C2C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C23H23N5O2/c1-27-14-17(12-25-27)9-10-24-13-19-15-28(20-5-3-2-4-6-20)26-23(19)18-7-8-21-22(11-18)30-16-29-21/h2-8,11-12,14-15,24H,9-10,13,16H2,1H3