N4,N4-dimethyl-N1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzene-1,4-disulfonamide

Systemtic Name: N4,N4-dimethyl-N1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzene-1,4-disulfonamide Openeye Name: N4,N4-dimethyl-N1-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzene-1,4-disulfonamide CAS Name: N4,N4-dimethyl-N1-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-dimethyl-1-N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzene-1,4-disulfonamide Traditional Name: N',N'-dimethyl-N-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]phenyl]benzene-1,4-disulfonamide Formula: C17H19N5O4S3 MolecularWeight: 453.55886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CN1C=NN=C1SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C17H19N5O4S3/c1-21(2)29(25,26)16-10-8-15(9-11-16)28(23,24)20-13-4-6-14(7-5-13)27-17-19-18-12-22(17)3/h4-12,20H,1-3H3