2-[[4-[3,4-bis(chloranyl)phenoxy]phenyl]methylsulfinyl]-1-piperazin-1-yl-ethanone

Systemtic Name: 2-[[4-[3,4-bis(chloranyl)phenoxy]phenyl]methylsulfinyl]-1-piperazin-1-yl-ethanone Openeye Name: 2-[[4-(3,4-dichlorophenoxy)phenyl]methylsulfinyl]-1-piperazin-1-yl-ethanone CAS Name: 2-[[4-(3,4-dichlorophenoxy)phenyl]methylsulfinyl]-1-(1-piperazinyl)ethanone IUPAC Name: 2-[[4-(3,4-dichlorophenoxy)phenyl]methylsulfinyl]-1-piperazin-1-ylethanone Traditional Name: 2-[4-(3,4-dichlorophenoxy)benzyl]sulfinyl-1-piperazino-ethanone Formula: C19H20Cl2N2O3S MolecularWeight: 427.3447

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)CS(=O)CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1)C(=O)CS(=O)CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H20Cl2N2O3S/c20-17-6-5-16(11-18(17)21)26-15-3-1-14(2-4-15)12-27(25)13-19(24)23-9-7-22-8-10-23/h1-6,11,22H,7-10,12-13H2