ethyl 1-(4-methoxyphenyl)-5-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methoxyphenyl)-5-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-methoxyphenyl)-5-[[4-(2-pyridylmethyl)piperazin-1-yl]methyl]pyrazole-4-carboxylate CAS Name: 1-(4-methoxyphenyl)-5-[[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methoxyphenyl)-5-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]pyrazole-4-carboxylate Traditional Name: 1-(4-methoxyphenyl)-5-[[4-(2-pyridylmethyl)piperazino]methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C24H29N5O3 MolecularWeight: 435.51876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C24H29N5O3/c1-3-32-24(30)22-16-26-29(20-7-9-21(31-2)10-8-20)23(22)18-28-14-12-27(13-15-28)17-19-6-4-5-11-25-19/h4-11,16H,3,12-15,17-18H2,1-2H3