N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(1-benzyl-1,2,4-triazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1-benzyl-1,2,4-triazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(1-benzyl-1,2,4-triazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C26H22N6O2 MolecularWeight: 450.49188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=N2)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC(=N2)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N6O2/c33-25(28-26-27-18-32(30-26)17-20-7-3-1-4-8-20)24-15-16-31(29-24)19-34-23-13-11-22(12-14-23)21-9-5-2-6-10-21/h1-16,18H,17,19H2,(H,28,30,33)