ethyl 4-(5-phenyl-4-pyridin-4-yl-1H-pyrazol-3-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-phenyl-4-pyridin-4-yl-1H-pyrazol-3-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-[5-phenyl-4-(4-pyridyl)-1H-pyrazol-3-yl]piperazine-1-carboxylate CAS Name: 4-(5-phenyl-4-pyridin-4-yl-1H-pyrazol-3-yl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-phenyl-4-pyridin-4-yl-1H-pyrazol-3-yl)piperazine-1-carboxylate Traditional Name: 4-[5-phenyl-4-(4-pyridyl)-1H-pyrazol-3-yl]piperazine-1-carboxylic acid ethyl ester Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NNC(=C2C3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NNC(=C2C3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2/c1-2-28-21(27)26-14-12-25(13-15-26)20-18(16-8-10-22-11-9-16)19(23-24-20)17-6-4-3-5-7-17/h3-11H,2,12-15H2,1H3,(H,23,24)