ethyl 4-[[1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C23H27N5O3 MolecularWeight: 421.49218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)N4C=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)N4C=CC=C4

InChI

InChI=1S/C23H27N5O3/c1-3-31-23(30)27-14-10-18(11-15-27)25-21(29)20-16-24-28(19-8-6-17(2)7-9-19)22(20)26-12-4-5-13-26/h4-9,12-13,16,18H,3,10-11,14-15H2,1-2H3,(H,25,29)