(5-bromanylpyridin-3-yl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[4-[(E)-styryl]sulfonylpiperazin-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[4-[(E)-styryl]sulfonylpiperazino]methanone Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CN=C2)Br)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3O3S/c19-17-12-16(13-20-14-17)18(23)21-7-9-22(10-8-21)26(24,25)11-6-15-4-2-1-3-5-15/h1-6,11-14H,7-10H2/b11-6+