3-(octylcarbamothioylamino)propanoic acid

Systemtic Name: 3-(octylcarbamothioylamino)propanoic acid Openeye Name: 3-(octylcarbamothioylamino)propanoic acid CAS Name: 3-[[(octylamino)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-(octylcarbamothioylamino)propanoic acid Traditional Name: 3-(octylthiocarbamoylamino)propionic acid Formula: C12H24N2O2S MolecularWeight: 260.39616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=S)NCCC(=O)O

Isomeric SMILES

CCCCCCCCNC(=S)NCCC(=O)O

InChI

InChI=1S/C12H24N2O2S/c1-2-3-4-5-6-7-9-13-12(17)14-10-8-11(15)16/h2-10H2,1H3,(H,15,16)(H2,13,14,17)