4-[2-[2,5-bis(chloranyl)phenyl]sulfanylethyl]piperazin-2-one

Systemtic Name: 4-[2-[2,5-bis(chloranyl)phenyl]sulfanylethyl]piperazin-2-one Openeye Name: 4-[2-(2,5-dichlorophenyl)sulfanylethyl]piperazin-2-one CAS Name: 4-[2-[(2,5-dichlorophenyl)thio]ethyl]-2-piperazinone IUPAC Name: 4-[2-(2,5-dichlorophenyl)sulfanylethyl]piperazin-2-one Traditional Name: 4-[2-[(2,5-dichlorophenyl)thio]ethyl]piperazin-2-one Formula: C12H14Cl2N2OS MolecularWeight: 305.22336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CCSC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1CN(CC(=O)N1)CCSC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C12H14Cl2N2OS/c13-9-1-2-10(14)11(7-9)18-6-5-16-4-3-15-12(17)8-16/h1-2,7H,3-6,8H2,(H,15,17)