4-oxidanylidene-3-(sulfanylmethyl)-1,5-thiazecane-6-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-(sulfanylmethyl)-1,5-thiazecane-6-carboxylic acid Openeye Name: 4-oxo-3-(sulfanylmethyl)-1,5-thiazecane-6-carboxylic acid CAS Name: 3-(mercaptomethyl)-4-oxo-1,5-thiazecane-6-carboxylic acid IUPAC Name: 4-oxo-3-(sulfanylmethyl)-1,5-thiazecane-6-carboxylic acid Traditional Name: 4-keto-3-(mercaptomethyl)-1,5-thiazecane-6-carboxylic acid Formula: C10H17NO3S2 MolecularWeight: 263.37688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCSCC(C(=O)NC(C1)C(=O)O)CS

Isomeric SMILES

C1CCSCC(C(=O)NC(C1)C(=O)O)CS

InChI

InChI=1S/C10H17NO3S2/c12-9-7(5-15)6-16-4-2-1-3-8(11-9)10(13)14/h7-8,15H,1-6H2,(H,11,12)(H,13,14)