ethyl 4-(4-chlorophenyl)-3-(1H-indol-3-yl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-3-(1H-indol-3-yl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-3-(1H-indol-3-yl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate CAS Name: 4-(4-chlorophenyl)-3-(1H-indol-3-yl)-2-phenyl-3H-1,2,4-triazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-3-(1H-indol-3-yl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate Traditional Name: 4-(4-chlorophenyl)-3-(1H-indol-3-yl)-2-phenyl-3H-1,2,4-triazole-5-carboxylic acid ethyl ester Formula: C25H21ClN4O2 MolecularWeight: 444.91284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(N1C2=CC=C(C=C2)Cl)C3=CNC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=NN(C(N1C2=CC=C(C=C2)Cl)C3=CNC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21ClN4O2/c1-2-32-25(31)23-28-30(19-8-4-3-5-9-19)24(29(23)18-14-12-17(26)13-15-18)21-16-27-22-11-7-6-10-20(21)22/h3-16,24,27H,2H2,1H3