3-[(3S)-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]-N-[2-(phenylmethylsulfanyl)ethyl]propanamide

Systemtic Name: 3-[(3S)-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]-N-[2-(phenylmethylsulfanyl)ethyl]propanamide Openeye Name: N-(2-benzylsulfanylethyl)-3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide CAS Name: 3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]-N-[2-(phenylmethylthio)ethyl]propanamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide Traditional Name: N-[2-(benzylthio)ethyl]-3-[(3S)-2-keto-3,4-dihydro-1H-quinolin-3-yl]propionamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=CC=CC=C21)CCC(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](C(=O)NC2=CC=CC=C21)CCC(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c24-20(22-12-13-26-15-16-6-2-1-3-7-16)11-10-18-14-17-8-4-5-9-19(17)23-21(18)25/h1-9,18H,10-15H2,(H,22,24)(H,23,25)/t18-/m0/s1