1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-chloro-2-thienyl)methylsulfanyl]ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-[(5-chloro-2-thiophenyl)methylthio]ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-chlorothiophen-2-yl)methylsulfanyl]ethanone Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]-1-(4-piperonylpiperazino)ethanone Formula: C19H21ClN2O3S2 MolecularWeight: 424.96464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CSCC4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CSCC4=CC=C(S4)Cl

InChI

InChI=1S/C19H21ClN2O3S2/c20-18-4-2-15(27-18)11-26-12-19(23)22-7-5-21(6-8-22)10-14-1-3-16-17(9-14)25-13-24-16/h1-4,9H,5-8,10-13H2