[4-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[(E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[(E)-3-(2-bromo-4-methylphenyl)-1-oxoprop-2-enyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[(E)-3-(2-bromo-4-methylphenyl)prop-2-enoyl]amino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[(E)-3-(2-bromo-4-methyl-phenyl)acryloyl]amino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C20H16BrN4O3S- MolecularWeight: 472.33504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3)Br

InChI

InChI=1S/C20H17BrN4O3S/c1-14-3-4-15(18(21)13-14)5-10-19(26)24-16-6-8-17(9-7-16)29(27,28)25-20-22-11-2-12-23-20/h2-13H,1H3,(H2,22,23,24,25,26)/p-1/b10-5+