5-(methylsulfanylcarbothioylamino)pentane-1-sulfonate

Systemtic Name: 5-(methylsulfanylcarbothioylamino)pentane-1-sulfonate Openeye Name: 5-(methylsulfanylcarbothioylamino)pentane-1-sulfonate CAS Name: 5-[[(methylthio)-sulfanylidenemethyl]amino]-1-pentanesulfonate IUPAC Name: 5-(methylsulfanylcarbothioylamino)pentane-1-sulfonate Traditional Name: 5-[(methylthio)carbothioylamino]pentane-1-sulfonate Formula: C7H14NO3S3- MolecularWeight: 256.38596

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)NCCCCCS(=O)(=O)[O-]

Isomeric SMILES

CSC(=S)NCCCCCS(=O)(=O)[O-]

InChI

InChI=1S/C7H15NO3S3/c1-13-7(12)8-5-3-2-4-6-14(9,10)11/h2-6H2,1H3,(H,8,12)(H,9,10,11)/p-1