tert-butyl 4-[2-(dibenzofuran-2-ylmethylsulfanyl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(dibenzofuran-2-ylmethylsulfanyl)ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(dibenzofuran-2-ylmethylsulfanyl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(2-dibenzofuranylmethylthio)-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(dibenzofuran-2-ylmethylsulfanyl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(dibenzofuran-2-ylmethylthio)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CSCC2=CC3=C(C=C2)OC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CSCC2=CC3=C(C=C2)OC4=CC=CC=C43

InChI

InChI=1S/C24H28N2O4S/c1-24(2,3)30-23(28)26-12-10-25(11-13-26)22(27)16-31-15-17-8-9-21-19(14-17)18-6-4-5-7-20(18)29-21/h4-9,14H,10-13,15-16H2,1-3H3