2-[(8-chloranyldibenzofuran-2-yl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(8-chloranyldibenzofuran-2-yl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone Openeye Name: 2-[(8-chlorodibenzofuran-2-yl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone CAS Name: 2-[(8-chloro-2-dibenzofuranyl)methylthio]-1-[4-(2-hydroxyethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(8-chlorodibenzofuran-2-yl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone Traditional Name: 2-[(8-chlorodibenzofuran-2-yl)methylthio]-1-[4-(2-hydroxyethyl)piperazino]ethanone Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)CSCC2=CC3=C(C=C2)OC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CCO)C(=O)CSCC2=CC3=C(C=C2)OC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN2O3S/c22-16-2-4-20-18(12-16)17-11-15(1-3-19(17)27-20)13-28-14-21(26)24-7-5-23(6-8-24)9-10-25/h1-4,11-12,25H,5-10,13-14H2