ethyl 4-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2-allylsulfanylanilino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[2-(allylthio)anilino]-2-keto-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C18H25N3O3S/c1-3-13-25-16-8-6-5-7-15(16)19-17(22)14-20-9-11-21(12-10-20)18(23)24-4-2/h3,5-8H,1,4,9-14H2,2H3,(H,19,22)