2,3-dimethyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2,3-dimethyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-nitro-benzenesulfonamide Openeye Name: 2,3-dimethyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-nitro-benzenesulfonamide CAS Name: 2,3-dimethyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2,3-dimethyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-nitrobenzenesulfonamide Traditional Name: 2,3-dimethyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-nitro-benzenesulfonamide Formula: C17H17N5O4S MolecularWeight: 387.41298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=CC(=C2)C3=NNC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=CC(=C2)C3=NNC(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4S/c1-10-7-15(22(23)24)9-16(11(10)2)27(25,26)21-14-6-4-5-13(8-14)17-18-12(3)19-20-17/h4-9,21H,1-3H3,(H,18,19,20)