N3-[2-methyl-3-(1,2,3,4-tetrazol-1-yl)phenyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[2-methyl-3-(1,2,3,4-tetrazol-1-yl)phenyl]benzene-1,3-disulfonamide Openeye Name: N3-[2-methyl-3-(tetrazol-1-yl)phenyl]benzene-1,3-disulfonamide CAS Name: N3-[2-methyl-3-(1-tetrazolyl)phenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[2-methyl-3-(tetrazol-1-yl)phenyl]benzene-1,3-disulfonamide Traditional Name: N'-[2-methyl-3-(tetrazol-1-yl)phenyl]benzene-1,3-disulfonamide Formula: C14H14N6O4S2 MolecularWeight: 394.42876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N)N3C=NN=N3

Isomeric SMILES

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N)N3C=NN=N3

InChI

InChI=1S/C14H14N6O4S2/c1-10-13(6-3-7-14(10)20-9-16-18-19-20)17-26(23,24)12-5-2-4-11(8-12)25(15,21)22/h2-9,17H,1H3,(H2,15,21,22)