1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-methylsulfanyl-propan-1-one

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-methylsulfanyl-propan-1-one Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-3-methylsulfanyl-propan-1-one CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-(methylthio)-1-propanone IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-3-methylsulfanylpropan-1-one Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-3-(methylthio)propan-1-one Formula: C12H17BrN2O3S3 MolecularWeight: 413.37398

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CSCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C12H17BrN2O3S3/c1-19-9-4-11(16)14-5-7-15(8-6-14)21(17,18)12-3-2-10(13)20-12/h2-3H,4-9H2,1H3