3-(hexylamino)-3-sulfanylidene-propanoic acid

Systemtic Name: 3-(hexylamino)-3-sulfanylidene-propanoic acid Openeye Name: 3-(hexylamino)-3-thioxo-propanoic acid CAS Name: 3-(hexylamino)-3-sulfanylidenepropanoic acid IUPAC Name: 3-(hexylamino)-3-sulfanylidenepropanoic acid Traditional Name: 3-(hexylamino)-3-thioxo-propionic acid Formula: C9H17NO2S MolecularWeight: 203.30178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)CC(=O)O

Isomeric SMILES

CCCCCCNC(=S)CC(=O)O

InChI

InChI=1S/C9H17NO2S/c1-2-3-4-5-6-10-8(13)7-9(11)12/h2-7H2,1H3,(H,10,13)(H,11,12)