[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylsulfanyl-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylsulfanyl-butan-2-yl]azanium Openeye Name: [(1S)-1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(methylthio)butan-2-yl]ammonium IUPAC Name: [(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylsulfanylbutan-2-yl]azanium Traditional Name: [(1S)-1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-(methylthio)propyl]ammonium Formula: C14H23N2S+ MolecularWeight: 251.41082

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(CN1CCC2=CC=CC=C2C1)[NH3+]

Isomeric SMILES

CSCC[C@@H](CN1CCC2=CC=CC=C2C1)[NH3+]

InChI

InChI=1S/C14H22N2S/c1-17-9-7-14(15)11-16-8-6-12-4-2-3-5-13(12)10-16/h2-5,14H,6-11,15H2,1H3/p+1/t14-/m0/s1