N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-N-(pyridin-4-ylmethyl)ethanamine

Systemtic Name: N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-N-(pyridin-4-ylmethyl)ethanamine Openeye Name: N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-N-(4-pyridylmethyl)ethanamine CAS Name: N-[[1-methyl-3-(4-phenoxyphenyl)-4-pyrazolyl]methyl]-N-(pyridin-4-ylmethyl)ethanamine IUPAC Name: N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-N-(pyridin-4-ylmethyl)ethanamine Traditional Name: ethyl-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-(4-pyridylmethyl)amine Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)CC2=CN(N=C2C3=CC=C(C=C3)OC4=CC=CC=C4)C

Isomeric SMILES

CCN(CC1=CC=NC=C1)CC2=CN(N=C2C3=CC=C(C=C3)OC4=CC=CC=C4)C

InChI

InChI=1S/C25H26N4O/c1-3-29(17-20-13-15-26-16-14-20)19-22-18-28(2)27-25(22)21-9-11-24(12-10-21)30-23-7-5-4-6-8-23/h4-16,18H,3,17,19H2,1-2H3