ethyl 4-azanyl-2-(4-chlorophenyl)-5-(1H-indol-3-ylcarbonyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-azanyl-2-(4-chlorophenyl)-5-(1H-indol-3-ylcarbonyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-amino-2-(4-chlorophenyl)-5-(1H-indole-3-carbonyl)pyrazole-3-carboxylate CAS Name: 4-amino-2-(4-chlorophenyl)-5-[1H-indol-3-yl(oxo)methyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(4-chlorophenyl)-5-(1H-indole-3-carbonyl)pyrazole-3-carboxylate Traditional Name: 4-amino-2-(4-chlorophenyl)-5-(1H-indole-3-carbonyl)pyrazole-3-carboxylic acid ethyl ester Formula: C21H17ClN4O3 MolecularWeight: 408.83768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)Cl)C(=O)C3=CNC4=CC=CC=C43)N

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)Cl)C(=O)C3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C21H17ClN4O3/c1-2-29-21(28)19-17(23)18(25-26(19)13-9-7-12(22)8-10-13)20(27)15-11-24-16-6-4-3-5-14(15)16/h3-11,24H,2,23H2,1H3