4-methyl-N-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)benzenesulfonamide

Systemtic Name: 4-methyl-N-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)benzenesulfonamide Openeye Name: 4-methyl-N-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)benzenesulfonamide CAS Name: 4-methyl-N-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)benzenesulfonamide IUPAC Name: 4-methyl-N-(3-propyl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)benzenesulfonamide Traditional Name: 4-methyl-N-(3-propyl-1,2,3,4-tetrahydro-s-triazine-3,5-diium-6-yl)benzenesulfonamide Formula: C13H22N4O2S+2 MolecularWeight: 298.40438

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CNC(=[NH+]C1)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC[NH+]1CNC(=[NH+]C1)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H20N4O2S/c1-3-8-17-9-14-13(15-10-17)16-20(18,19)12-6-4-11(2)5-7-12/h4-7H,3,8-10H2,1-2H3,(H2,14,15,16)/p+2