[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C16H19ClN3OS+ MolecularWeight: 336.85956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=C(N=CC=C2)Cl

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C16H18ClN3OS/c1-20(10-12-5-7-13(22-2)8-6-12)11-15(21)19-14-4-3-9-18-16(14)17/h3-9H,10-11H2,1-2H3,(H,19,21)/p+1