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

Systemtic Name: 2-methoxy-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-5-nitro-benzenesulfonamide Openeye Name: 2-methoxy-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-5-nitro-benzenesulfonamide CAS Name: 2-methoxy-N-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methoxy-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-5-nitrobenzenesulfonamide Traditional Name: 2-methoxy-N-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]-5-nitro-benzenesulfonamide Formula: C16H15N5O5S2 MolecularWeight: 421.4508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CN1C=NN=C1SC2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C16H15N5O5S2/c1-20-10-17-18-16(20)27-14-6-4-3-5-12(14)19-28(24,25)15-9-11(21(22)23)7-8-13(15)26-2/h3-10,19H,1-2H3