N-(2-methyl-5-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide CAS Name: N-(2-methyl-5-nitrophenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N5O3/c1-15-12-13-18(27(29)30)14-19(15)23-22(28)20-24-21(16-8-4-2-5-9-16)26(25-20)17-10-6-3-7-11-17/h2-14H,1H3,(H,23,28)