4-[methyl-(4-nitrophenyl)sulfonyl-amino]-N-(1,2,4-triazol-4-yl)butanamide

Systemtic Name: 4-[methyl-(4-nitrophenyl)sulfonyl-amino]-N-(1,2,4-triazol-4-yl)butanamide Openeye Name: 4-[methyl-(4-nitrophenyl)sulfonyl-amino]-N-(1,2,4-triazol-4-yl)butanamide CAS Name: 4-[methyl-(4-nitrophenyl)sulfonylamino]-N-(1,2,4-triazol-4-yl)butanamide IUPAC Name: 4-[methyl-(4-nitrophenyl)sulfonylamino]-N-(1,2,4-triazol-4-yl)butanamide Traditional Name: 4-[methyl(nosyl)amino]-N-(1,2,4-triazol-4-yl)butyramide Formula: C13H16N6O5S MolecularWeight: 368.36834

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NN1C=NN=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CCCC(=O)NN1C=NN=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N6O5S/c1-17(8-2-3-13(20)16-18-9-14-15-10-18)25(23,24)12-6-4-11(5-7-12)19(21)22/h4-7,9-10H,2-3,8H2,1H3,(H,16,20)