ethyl 4-[2-(3-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(3-chlorophenyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H24ClN5O3 MolecularWeight: 441.91066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=CN4C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=CN4C

InChI

InChI=1S/C22H24ClN5O3/c1-3-31-22(30)27-12-10-26(11-13-27)21(29)20-15-18(19-8-5-9-25(19)2)24-28(20)17-7-4-6-16(23)14-17/h4-9,14-15H,3,10-13H2,1-2H3