dimethyl-[(1S)-1-thiophen-3-yl-2-[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[(1S)-1-thiophen-3-yl-2-[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[(1S)-1-(3-thienyl)-2-[[2-(2-thienylmethylsulfanyl)benzoyl]amino]ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo-[2-(thiophen-2-ylmethylthio)phenyl]methyl]amino]-1-(3-thiophenyl)ethyl]ammonium IUPAC Name: dimethyl-[(1S)-1-thiophen-3-yl-2-[[2-(thiophen-2-ylmethylsulfanyl)benzoyl]amino]ethyl]azanium Traditional Name: dimethyl-[(1S)-2-[[2-(2-thenylthio)benzoyl]amino]-1-(3-thienyl)ethyl]ammonium Formula: C20H23N2OS3+ MolecularWeight: 403.60442

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC=CC=C1SCC2=CC=CS2)C3=CSC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC=CC=C1SCC2=CC=CS2)C3=CSC=C3

InChI

InChI=1S/C20H22N2OS3/c1-22(2)18(15-9-11-24-13-15)12-21-20(23)17-7-3-4-8-19(17)26-14-16-6-5-10-25-16/h3-11,13,18H,12,14H2,1-2H3,(H,21,23)/p+1/t18-/m1/s1