O-propan-2-yl [2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-propan-2-yl [2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-isopropyl [2-[2-(cyanomethylsulfanyl)anilino]-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-[2-(cyanomethylthio)anilino]-2-oxoethyl]thio]methanethioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl [2-[2-(cyanomethylsulfanyl)anilino]-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-[2-(cyanomethylthio)anilino]-2-keto-ethyl]thio]methanethioic acid O-isopropyl ester Formula: C14H16N2O2S3 MolecularWeight: 340.48404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)SCC(=O)NC1=CC=CC=C1SCC#N

Isomeric SMILES

CC(C)OC(=S)SCC(=O)NC1=CC=CC=C1SCC#N

InChI

InChI=1S/C14H16N2O2S3/c1-10(2)18-14(19)21-9-13(17)16-11-5-3-4-6-12(11)20-8-7-15/h3-6,10H,8-9H2,1-2H3,(H,16,17)