N-[4-(hydroxymethyl)-3-oxidanylidene-1-sulfanyl-hex-5-en-2-yl]ethanamide

Systemtic Name: N-[4-(hydroxymethyl)-3-oxidanylidene-1-sulfanyl-hex-5-en-2-yl]ethanamide Openeye Name: N-[3-(hydroxymethyl)-2-oxo-1-(sulfanylmethyl)pent-4-enyl]acetamide CAS Name: N-[4-(hydroxymethyl)-1-mercapto-3-oxohex-5-en-2-yl]acetamide IUPAC Name: N-[4-(hydroxymethyl)-3-oxo-1-sulfanylhex-5-en-2-yl]acetamide Traditional Name: N-[2-keto-1-(mercaptomethyl)-3-methylol-pent-4-enyl]acetamide Formula: C9H15NO3S MolecularWeight: 217.2853

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CS)C(=O)C(CO)C=C

Isomeric SMILES

CC(=O)NC(CS)C(=O)C(CO)C=C

InChI

InChI=1S/C9H15NO3S/c1-3-7(4-11)9(13)8(5-14)10-6(2)12/h3,7-8,11,14H,1,4-5H2,2H3,(H,10,12)