1-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-4-ethyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-4-ethyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoylamino]-4-ethyl-cyclohexanecarboxylic acid CAS Name: 1-[[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]amino]-4-ethyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[3-(2-amino-2-oxoethyl)sulfanylpropanoylamino]-4-ethylcyclohexane-1-carboxylic acid Traditional Name: 1-[3-[(2-amino-2-keto-ethyl)thio]propanoylamino]-4-ethyl-cyclohexanecarboxylic acid Formula: C14H24N2O4S MolecularWeight: 316.41636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)CCSCC(=O)N

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)CCSCC(=O)N

InChI

InChI=1S/C14H24N2O4S/c1-2-10-3-6-14(7-4-10,13(19)20)16-12(18)5-8-21-9-11(15)17/h10H,2-9H2,1H3,(H2,15,17)(H,16,18)(H,19,20)