1-[6-[(2S)-3-(methylamino)-2-oxidanyl-propyl]sulfanyl-3,4-dihydro-2H-quinolin-1-yl]ethanone

Systemtic Name: 1-[6-[(2S)-3-(methylamino)-2-oxidanyl-propyl]sulfanyl-3,4-dihydro-2H-quinolin-1-yl]ethanone Openeye Name: 1-[6-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfanyl-3,4-dihydro-2H-quinolin-1-yl]ethanone CAS Name: 1-[6-[[(2S)-2-hydroxy-3-(methylamino)propyl]thio]-3,4-dihydro-2H-quinolin-1-yl]ethanone IUPAC Name: 1-[6-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfanyl-3,4-dihydro-2H-quinolin-1-yl]ethanone Traditional Name: 1-[6-[[(2S)-2-hydroxy-3-(methylamino)propyl]thio]-3,4-dihydro-2H-quinolin-1-yl]ethanone Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)SCC(CNC)O

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)SC[C@H](CNC)O

InChI

InChI=1S/C15H22N2O2S/c1-11(18)17-7-3-4-12-8-14(5-6-15(12)17)20-10-13(19)9-16-2/h5-6,8,13,16,19H,3-4,7,9-10H2,1-2H3/t13-/m0/s1