5-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-N,N,3-trimethyl-thiophene-2-carboxamide

Systemtic Name: 5-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-N,N,3-trimethyl-thiophene-2-carboxamide Openeye Name: 5-[[(E)-3-(5-bromo-2-fluoro-phenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-N,N,3-trimethyl-thiophene-2-carboxamide CAS Name: 5-[[(E)-3-(5-bromo-2-fluorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-cyano-N,N,3-trimethyl-2-thiophenecarboxamide IUPAC Name: 5-[[(E)-3-(5-bromo-2-fluorophenyl)-2-cyanoprop-2-enoyl]amino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide Traditional Name: 5-[[(E)-3-(5-bromo-2-fluoro-phenyl)-2-cyano-acryloyl]amino]-4-cyano-N,N,3-trimethyl-thiophene-2-carboxamide Formula: C19H14BrFN4O2S MolecularWeight: 461.307463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C(=CC2=C(C=CC(=C2)Br)F)C#N)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)/C(=C/C2=C(C=CC(=C2)Br)F)/C#N)C(=O)N(C)C

InChI

InChI=1S/C19H14BrFN4O2S/c1-10-14(9-23)18(28-16(10)19(27)25(2)3)24-17(26)12(8-22)6-11-7-13(20)4-5-15(11)21/h4-7H,1-3H3,(H,24,26)/b12-6+