[(2R)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(4-methylsulfanylphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(4-methylsulfanylphenyl)ethyl]azanium Openeye Name: [(2R)-2-[(2S)-2-methylindolin-1-yl]-2-(4-methylsulfanylphenyl)ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[4-(methylthio)phenyl]ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(4-methylsulfanylphenyl)ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-methylindolin-1-yl]-2-[4-(methylthio)phenyl]ethyl]ammonium Formula: C18H23N2S+ MolecularWeight: 299.45362

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(C[NH3+])C3=CC=C(C=C3)SC

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1[C@@H](C[NH3+])C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H22N2S/c1-13-11-15-5-3-4-6-17(15)20(13)18(12-19)14-7-9-16(21-2)10-8-14/h3-10,13,18H,11-12,19H2,1-2H3/p+1/t13-,18-/m0/s1