ethyl 4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-(methylthio)anilino]-2-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-methylsulfanylanilino)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-[3-(methylthio)anilino]ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C16H23N3O3S/c1-3-22-16(21)19-9-7-18(8-10-19)12-15(20)17-13-5-4-6-14(11-13)23-2/h4-6,11H,3,7-10,12H2,1-2H3,(H,17,20)