[5-azanyl-3-[(3-phenylmethoxyphenyl)amino]-1,2,4-triazol-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [5-azanyl-3-[(3-phenylmethoxyphenyl)amino]-1,2,4-triazol-1-yl]-(4-methylphenyl)methanone Openeye Name: [5-amino-3-(3-benzyloxyanilino)-1,2,4-triazol-1-yl]-(p-tolyl)methanone CAS Name: [5-amino-3-(3-phenylmethoxyanilino)-1,2,4-triazol-1-yl]-(4-methylphenyl)methanone IUPAC Name: [5-amino-3-(3-phenylmethoxyanilino)-1,2,4-triazol-1-yl]-(4-methylphenyl)methanone Traditional Name: [5-amino-3-(3-benzoxyanilino)-1,2,4-triazol-1-yl]-(p-tolyl)methanone Formula: C23H21N5O2 MolecularWeight: 399.44514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)NC3=CC(=CC=C3)OCC4=CC=CC=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)NC3=CC(=CC=C3)OCC4=CC=CC=C4)N

InChI

InChI=1S/C23H21N5O2/c1-16-10-12-18(13-11-16)21(29)28-22(24)26-23(27-28)25-19-8-5-9-20(14-19)30-15-17-6-3-2-4-7-17/h2-14H,15H2,1H3,(H3,24,25,26,27)