[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Openeye Name: [5-[(4-chlorophenyl)methylamino]-3-(p-tolyl)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone CAS Name: [5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: [5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Traditional Name: [5-[(4-chlorobenzyl)amino]-3-(p-tolyl)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Formula: C23H18ClN5O3 MolecularWeight: 447.87372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClN5O3/c1-15-2-6-17(7-3-15)21-26-23(25-14-16-4-10-19(24)11-5-16)28(27-21)22(30)18-8-12-20(13-9-18)29(31)32/h2-13H,14H2,1H3,(H,25,26,27)