phenyl-[3-phenyl-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]methanone

Systemtic Name: phenyl-[3-phenyl-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]methanone Openeye Name: [5-(benzylamino)-3-phenyl-1,2,4-triazol-1-yl]-phenyl-methanone CAS Name: phenyl-[3-phenyl-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]methanone IUPAC Name: [5-(benzylamino)-3-phenyl-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [5-(benzylamino)-3-phenyl-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O/c27-21(19-14-8-3-9-15-19)26-22(23-16-17-10-4-1-5-11-17)24-20(25-26)18-12-6-2-7-13-18/h1-15H,16H2,(H,23,24,25)