(E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-bromo-3-nitro-phenyl)-2-cyano-N-thiazol-2-yl-prop-2-enamide CAS Name: (E)-3-(4-bromo-3-nitrophenyl)-2-cyano-N-(2-thiazolyl)-2-propenamide IUPAC Name: (E)-3-(4-bromo-3-nitrophenyl)-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-bromo-3-nitro-phenyl)-2-cyano-N-thiazol-2-yl-acrylamide Formula: C13H7BrN4O3S MolecularWeight: 379.18868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C(C#N)C(=O)NC2=NC=CS2)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1/C=C(\C#N)/C(=O)NC2=NC=CS2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H7BrN4O3S/c14-10-2-1-8(6-11(10)18(20)21)5-9(7-15)12(19)17-13-16-3-4-22-13/h1-6H,(H,16,17,19)/b9-5+