2-[2-[[(6S)-3-cyano-6-ethyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]ethanoylamino]ethanoate

Systemtic Name: 2-[2-[[(6S)-3-cyano-6-ethyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]ethanoylamino]ethanoate Openeye Name: 2-[[2-[[(6S)-3-cyano-6-ethyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[[(6S)-3-cyano-6-ethyl-5,6,7,8-tetrahydroquinolin-2-yl]thio]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[[(6S)-3-cyano-6-ethyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[[(6S)-3-cyano-6-ethyl-5,6,7,8-tetrahydroquinolin-2-yl]thio]acetyl]amino]acetate Formula: C16H18N3O3S- MolecularWeight: 332.39742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(C(=N2)SCC(=O)NCC(=O)[O-])C#N

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(C(=N2)SCC(=O)NCC(=O)[O-])C#N

InChI

InChI=1S/C16H19N3O3S/c1-2-10-3-4-13-11(5-10)6-12(7-17)16(19-13)23-9-14(20)18-8-15(21)22/h6,10H,2-5,8-9H2,1H3,(H,18,20)(H,21,22)/p-1/t10-/m0/s1