(E)-3-[(5-bromanylpyridin-2-yl)amino]-2-(4-methylphenyl)sulfonyl-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-[(5-bromanylpyridin-2-yl)amino]-2-(4-methylphenyl)sulfonyl-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[(5-bromo-2-pyridyl)amino]-1-phenyl-2-(p-tolylsulfonyl)prop-2-en-1-one CAS Name: (E)-3-[(5-bromo-2-pyridinyl)amino]-2-(4-methylphenyl)sulfonyl-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[(5-bromopyridin-2-yl)amino]-2-(4-methylphenyl)sulfonyl-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[(5-bromo-2-pyridyl)amino]-1-phenyl-2-tosyl-prop-2-en-1-one Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=NC=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/NC2=NC=C(C=C2)Br)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17BrN2O3S/c1-15-7-10-18(11-8-15)28(26,27)19(21(25)16-5-3-2-4-6-16)14-24-20-12-9-17(22)13-23-20/h2-14H,1H3,(H,23,24)/b19-14+