(4-methylsulfanylphenyl)methyl-[(2R)-4-phenylbutan-2-yl]azanium

Systemtic Name: (4-methylsulfanylphenyl)methyl-[(2R)-4-phenylbutan-2-yl]azanium Openeye Name: [(1R)-1-methyl-3-phenyl-propyl]-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [4-(methylthio)phenyl]methyl-[(2R)-4-phenylbutan-2-yl]ammonium IUPAC Name: (4-methylsulfanylphenyl)methyl-[(2R)-4-phenylbutan-2-yl]azanium Traditional Name: [(1R)-1-methyl-3-phenyl-propyl]-[4-(methylthio)benzyl]ammonium Formula: C18H24NS+ MolecularWeight: 286.45486

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH2+]CC2=CC=C(C=C2)SC

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)[NH2+]CC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H23NS/c1-15(8-9-16-6-4-3-5-7-16)19-14-17-10-12-18(20-2)13-11-17/h3-7,10-13,15,19H,8-9,14H2,1-2H3/p+1/t15-/m1/s1