2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: 2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]acetamide CAS Name: 2-(3-methyl-5-nitro-1-pyrazolyl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide IUPAC Name: 2-(3-methyl-5-nitropyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]acetamide Traditional Name: N-[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]-2-(3-methyl-5-nitro-pyrazol-1-yl)acetamide Formula: C16H17N7O3 MolecularWeight: 355.35128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)CN3C(=CC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=O)CN3C(=CC(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O3/c1-11-4-3-5-13(6-11)8-21-10-17-16(20-21)18-14(24)9-22-15(23(25)26)7-12(2)19-22/h3-7,10H,8-9H2,1-2H3,(H,18,20,24)