5-methyl-N-(2-morpholin-4-ylphenyl)-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxamide

Systemtic Name: 5-methyl-N-(2-morpholin-4-ylphenyl)-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxamide Openeye Name: 5-methyl-N-(2-morpholinophenyl)-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxamide CAS Name: 5-methyl-N-[2-(4-morpholinyl)phenyl]-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 5-methyl-N-(2-morpholin-4-ylphenyl)-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxamide Traditional Name: 5-methyl-N-(2-morpholinophenyl)-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxamide Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3N4CCOCC4

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3N4CCOCC4

InChI

InChI=1S/C20H20N6O4/c1-14-21-19(23-25(14)15-6-8-16(9-7-15)26(28)29)20(27)22-17-4-2-3-5-18(17)24-10-12-30-13-11-24/h2-9H,10-13H2,1H3,(H,22,27)