dimethyl-[(2R)-1-phenyl-3-[(2-phenylsulfanylpyridin-3-yl)carbonylamino]propan-2-yl]azanium

Systemtic Name: dimethyl-[(2R)-1-phenyl-3-[(2-phenylsulfanylpyridin-3-yl)carbonylamino]propan-2-yl]azanium Openeye Name: [(1R)-1-benzyl-2-[(2-phenylsulfanylpyridine-3-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: dimethyl-[(2R)-1-[[oxo-[2-(phenylthio)-3-pyridinyl]methyl]amino]-3-phenylpropan-2-yl]ammonium IUPAC Name: dimethyl-[(2R)-1-phenyl-3-[(2-phenylsulfanylpyridine-3-carbonyl)amino]propan-2-yl]azanium Traditional Name: [(1R)-1-benzyl-2-[[2-(phenylthio)nicotinoyl]amino]ethyl]-dimethyl-ammonium Formula: C23H26N3OS+ MolecularWeight: 392.53704

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CC1=CC=CC=C1)CNC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CC1=CC=CC=C1)CNC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C23H25N3OS/c1-26(2)19(16-18-10-5-3-6-11-18)17-25-22(27)21-14-9-15-24-23(21)28-20-12-7-4-8-13-20/h3-15,19H,16-17H2,1-2H3,(H,25,27)/p+1/t19-/m1/s1