1-[1-[(2-methylphenyl)methyl]-1,2,4-triazol-3-yl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[1-[(2-methylphenyl)methyl]-1,2,4-triazol-3-yl]-3-(4-nitrophenyl)urea Openeye Name: 1-(4-nitrophenyl)-3-[1-(o-tolylmethyl)-1,2,4-triazol-3-yl]urea CAS Name: 1-[1-[(2-methylphenyl)methyl]-1,2,4-triazol-3-yl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[1-[(2-methylphenyl)methyl]-1,2,4-triazol-3-yl]-3-(4-nitrophenyl)urea Traditional Name: 1-[1-(2-methylbenzyl)-1,2,4-triazol-3-yl]-3-(4-nitrophenyl)urea Formula: C17H16N6O3 MolecularWeight: 352.34734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=NC(=N2)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=NC(=N2)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N6O3/c1-12-4-2-3-5-13(12)10-22-11-18-16(21-22)20-17(24)19-14-6-8-15(9-7-14)23(25)26/h2-9,11H,10H2,1H3,(H2,19,20,21,24)