sodium (pyridin-2-ylcarbamothioylamino)methanesulfonate

Systemtic Name: sodium (pyridin-2-ylcarbamothioylamino)methanesulfonate Openeye Name: sodium (2-pyridylcarbamothioylamino)methanesulfonate CAS Name: sodium [[(2-pyridinylamino)-sulfanylidenemethyl]amino]methanesulfonate IUPAC Name: sodium (pyridin-2-ylcarbamothioylamino)methanesulfonate Traditional Name: sodium (2-pyridylthiocarbamoylamino)methanesulfonate Formula: C7H8N3NaO3S2 MolecularWeight: 269.27649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=S)NCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=NC(=C1)NC(=S)NCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C7H9N3O3S2.Na/c11-15(12,13)5-9-7(14)10-6-3-1-2-4-8-6;/h1-4H,5H2,(H,11,12,13)(H2,8,9,10,14);/q;+1/p-1