ethyl 1-(2-methylphenyl)-5-[[(2-phenyl-1,2,3-triazol-4-yl)methylamino]methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2-methylphenyl)-5-[[(2-phenyl-1,2,3-triazol-4-yl)methylamino]methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(o-tolyl)-5-[[(2-phenyltriazol-4-yl)methylamino]methyl]pyrazole-4-carboxylate CAS Name: 1-(2-methylphenyl)-5-[[(2-phenyl-4-triazolyl)methylamino]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methylphenyl)-5-[[(2-phenyltriazol-4-yl)methylamino]methyl]pyrazole-4-carboxylate Traditional Name: 1-(o-tolyl)-5-[[(2-phenyltriazol-4-yl)methylamino]methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H24N6O2 MolecularWeight: 416.47566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2C)CNCC3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2C)CNCC3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H24N6O2/c1-3-31-23(30)20-15-25-28(21-12-8-7-9-17(21)2)22(20)16-24-13-18-14-26-29(27-18)19-10-5-4-6-11-19/h4-12,14-15,24H,3,13,16H2,1-2H3