2-(prop-2-enylcarbamothioylamino)ethanesulfonic acid

Systemtic Name: 2-(prop-2-enylcarbamothioylamino)ethanesulfonic acid Openeye Name: 2-(allylcarbamothioylamino)ethanesulfonic acid CAS Name: 2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]ethanesulfonic acid IUPAC Name: 2-(prop-2-enylcarbamothioylamino)ethanesulfonic acid Traditional Name: 2-(allylthiocarbamoylamino)ethanesulfonic acid Formula: C6H12N2O3S2 MolecularWeight: 224.30108

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NCCS(=O)(=O)O

Isomeric SMILES

C=CCNC(=S)NCCS(=O)(=O)O

InChI

InChI=1S/C6H12N2O3S2/c1-2-3-7-6(12)8-4-5-13(9,10)11/h2H,1,3-5H2,(H2,7,8,12)(H,9,10,11)