2-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetyl]amino]acetic acid CAS Name: 2-[[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetyl]amino]acetic acid Traditional Name: 2-[[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetyl]amino]acetic acid Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)NCC(=O)O)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)NCC(=O)O)C#N

InChI

InChI=1S/C15H17N3O3S/c1-9-2-3-12-10(4-9)5-11(6-16)15(18-12)22-8-13(19)17-7-14(20)21/h5,9H,2-4,7-8H2,1H3,(H,17,19)(H,20,21)