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2-cyanoethyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium

2-cyanoethyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name:2-cyanoethyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium
Openeye Name:2-cyanoethyl-methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]ammonium
CAS Name:2-cyanoethyl-methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]ammonium
IUPAC Name:2-cyanoethyl-methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]azanium
Traditional Name:2-cyanoethyl-[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-ammonium
Formula: C13H18N3OS+
MolecularWeight: 264.36652
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC#N)CC(=O)NC1=CC=CC=C1SC


Isomeric SMILES

C[NH+](CCC#N)CC(=O)NC1=CC=CC=C1SC


InChI

InChI=1S/C13H17N3OS/c1-16(9-5-8-14)10-13(17)15-11-6-3-4-7-12(11)18-2/h3-4,6-7H,5,9-10H2,1-2H3,(H,15,17)/p+1


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