(phenylmethyl) 4-[2-(dibenzofuran-2-ylmethylsulfinyl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-(dibenzofuran-2-ylmethylsulfinyl)ethanoyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[2-(dibenzofuran-2-ylmethylsulfinyl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(2-dibenzofuranylmethylsulfinyl)-1-oxoethyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-(dibenzofuran-2-ylmethylsulfinyl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(dibenzofuran-2-ylmethylsulfinyl)acetyl]piperazine-1-carboxylic acid benzyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CS(=O)CC2=CC3=C(C=C2)OC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)CS(=O)CC2=CC3=C(C=C2)OC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C27H26N2O5S/c30-26(28-12-14-29(15-13-28)27(31)33-17-20-6-2-1-3-7-20)19-35(32)18-21-10-11-25-23(16-21)22-8-4-5-9-24(22)34-25/h1-11,16H,12-15,17-19H2