methyl 6-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]carbothioylamino]hexanoate

Systemtic Name: methyl 6-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]carbothioylamino]hexanoate Openeye Name: methyl 6-[[(2S)-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioyl]amino]hexanoate CAS Name: 6-[[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(2S)-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioyl]amino]hexanoate Traditional Name: 6-[[(2S)-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioyl]amino]hexanoic acid methyl ester Formula: C18H26N2O2S MolecularWeight: 334.47624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC=CC=C2N1C(=S)NCCCCCC(=O)OC

Isomeric SMILES

C[C@H]1CCC2=CC=CC=C2N1C(=S)NCCCCCC(=O)OC

InChI

InChI=1S/C18H26N2O2S/c1-14-11-12-15-8-5-6-9-16(15)20(14)18(23)19-13-7-3-4-10-17(21)22-2/h5-6,8-9,14H,3-4,7,10-13H2,1-2H3,(H,19,23)/t14-/m0/s1