methyl-[(4-methylsulfanylphenyl)methyl]-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium Openeye Name: [(1R)-2-(benzylamino)-1-methyl-2-oxo-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]ammonium IUPAC Name: [(2R)-1-(benzylamino)-1-oxopropan-2-yl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [(1R)-2-(benzylamino)-2-keto-1-methyl-ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)SC

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C19H24N2OS/c1-15(19(22)20-13-16-7-5-4-6-8-16)21(2)14-17-9-11-18(23-3)12-10-17/h4-12,15H,13-14H2,1-3H3,(H,20,22)/p+1/t15-/m1/s1