(Z)-3-(4-bromanylthiophen-2-yl)-2-cyano-N-(1-methylpyrazol-3-yl)prop-2-enamide

Systemtic Name: (Z)-3-(4-bromanylthiophen-2-yl)-2-cyano-N-(1-methylpyrazol-3-yl)prop-2-enamide Openeye Name: (Z)-3-(4-bromo-2-thienyl)-2-cyano-N-(1-methylpyrazol-3-yl)prop-2-enamide CAS Name: (Z)-3-(4-bromo-2-thiophenyl)-2-cyano-N-(1-methyl-3-pyrazolyl)-2-propenamide IUPAC Name: (Z)-3-(4-bromothiophen-2-yl)-2-cyano-N-(1-methylpyrazol-3-yl)prop-2-enamide Traditional Name: (Z)-3-(4-bromo-2-thienyl)-2-cyano-N-(1-methylpyrazol-3-yl)acrylamide Formula: C12H9BrN4OS MolecularWeight: 337.19506

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C(=CC2=CC(=CS2)Br)C#N

Isomeric SMILES

CN1C=CC(=N1)NC(=O)/C(=C\C2=CC(=CS2)Br)/C#N

InChI

InChI=1S/C12H9BrN4OS/c1-17-3-2-11(16-17)15-12(18)8(6-14)4-10-5-9(13)7-19-10/h2-5,7H,1H3,(H,15,16,18)/b8-4-