5-nitro-2-[3-(1,2,4-triazol-1-yl)propylamino]benzenesulfonamide

Systemtic Name: 5-nitro-2-[3-(1,2,4-triazol-1-yl)propylamino]benzenesulfonamide Openeye Name: 5-nitro-2-[3-(1,2,4-triazol-1-yl)propylamino]benzenesulfonamide CAS Name: 5-nitro-2-[3-(1,2,4-triazol-1-yl)propylamino]benzenesulfonamide IUPAC Name: 5-nitro-2-[3-(1,2,4-triazol-1-yl)propylamino]benzenesulfonamide Traditional Name: 5-nitro-2-[3-(1,2,4-triazol-1-yl)propylamino]benzenesulfonamide Formula: C11H14N6O4S MolecularWeight: 326.33166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)N)NCCCN2C=NC=N2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)N)NCCCN2C=NC=N2

InChI

InChI=1S/C11H14N6O4S/c12-22(20,21)11-6-9(17(18)19)2-3-10(11)14-4-1-5-16-8-13-7-15-16/h2-3,6-8,14H,1,4-5H2,(H2,12,20,21)