3-(pentylamino)-3-sulfanylidene-propanoic acid

Systemtic Name: 3-(pentylamino)-3-sulfanylidene-propanoic acid Openeye Name: 3-(pentylamino)-3-thioxo-propanoic acid CAS Name: 3-(pentylamino)-3-sulfanylidenepropanoic acid IUPAC Name: 3-(pentylamino)-3-sulfanylidenepropanoic acid Traditional Name: 3-(amylamino)-3-thioxo-propionic acid Formula: C8H15NO2S MolecularWeight: 189.2752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)CC(=O)O

Isomeric SMILES

CCCCCNC(=S)CC(=O)O

InChI

InChI=1S/C8H15NO2S/c1-2-3-4-5-9-7(12)6-8(10)11/h2-6H2,1H3,(H,9,12)(H,10,11)