(2S)-2-(3,4-dihydro-2H-quinolin-1-ylcarbonylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-(3,4-dihydro-2H-quinolin-1-ylcarbonylamino)-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-4-(methylthio)butyric acid Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)N1CCCC2=CC=CC=C21

Isomeric SMILES

CSCC[C@@H](C(=O)O)NC(=O)N1CCCC2=CC=CC=C21

InChI

InChI=1S/C15H20N2O3S/c1-21-10-8-12(14(18)19)16-15(20)17-9-4-6-11-5-2-3-7-13(11)17/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,20)(H,18,19)/t12-/m0/s1