ethyl 4-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(2-methoxy-4-methylsulfanyl-benzoyl)piperazine-1-carboxylate CAS Name: 4-[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methoxy-4-methylsulfanylbenzoyl)piperazine-1-carboxylate Traditional Name: 4-[2-methoxy-4-(methylthio)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C=C(C=C2)SC)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C=C(C=C2)SC)OC

InChI

InChI=1S/C16H22N2O4S/c1-4-22-16(20)18-9-7-17(8-10-18)15(19)13-6-5-12(23-3)11-14(13)21-2/h5-6,11H,4,7-10H2,1-3H3