2-(4-sulfanylidene-1,3,5-triazinan-1-yl)ethanesulfonic acid

Systemtic Name: 2-(4-sulfanylidene-1,3,5-triazinan-1-yl)ethanesulfonic acid Openeye Name: 2-(4-thioxo-1,3,5-triazinan-1-yl)ethanesulfonic acid CAS Name: 2-(4-sulfanylidene-1,3,5-triazinan-1-yl)ethanesulfonic acid IUPAC Name: 2-(4-sulfanylidene-1,3,5-triazinan-1-yl)ethanesulfonic acid Traditional Name: 2-(4-thioxo-1,3,5-triazinan-1-yl)ethanesulfonic acid Formula: C5H11N3O3S2 MolecularWeight: 225.28914

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)NCN1CCS(=O)(=O)O

Isomeric SMILES

C1NC(=S)NCN1CCS(=O)(=O)O

InChI

InChI=1S/C5H11N3O3S2/c9-13(10,11)2-1-8-3-6-5(12)7-4-8/h1-4H2,(H2,6,7,12)(H,9,10,11)