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

Systemtic Name: ethyl 4-azanyl-5-(1H-indol-3-ylcarbonyl)-2-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-amino-5-(1H-indole-3-carbonyl)-2-phenyl-pyrazole-3-carboxylate CAS Name: 4-amino-5-[1H-indol-3-yl(oxo)methyl]-2-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-(1H-indole-3-carbonyl)-2-phenylpyrazole-3-carboxylate Traditional Name: 4-amino-5-(1H-indole-3-carbonyl)-2-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C21H18N4O3 MolecularWeight: 374.39262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O3/c1-2-28-21(27)19-17(22)18(24-25(19)13-8-4-3-5-9-13)20(26)15-12-23-16-11-7-6-10-14(15)16/h3-12,23H,2,22H2,1H3