tert-butyl 4-(3-methylsulfanyloxyphenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-methylsulfanyloxyphenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-methylsulfanyloxyphenyl)piperazine-1-carboxylate CAS Name: 4-[3-(methylthio)oxyphenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-methylsulfanyloxyphenyl)piperazine-1-carboxylate Traditional Name: 4-[3-(methylthio)oxyphenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)OSC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)OSC

InChI

InChI=1S/C16H24N2O3S/c1-16(2,3)20-15(19)18-10-8-17(9-11-18)13-6-5-7-14(12-13)21-22-4/h5-7,12H,8-11H2,1-4H3