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

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-3-(3-pyridyl)propan-1-one Formula: C16H18BrN3O3S2 MolecularWeight: 444.36642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H18BrN3O3S2/c17-14-4-6-16(24-14)25(22,23)20-10-8-19(9-11-20)15(21)5-3-13-2-1-7-18-12-13/h1-2,4,6-7,12H,3,5,8-11H2