3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-thiazol-2-yl-prop-2-enamide CAS Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(2-thiazolyl)-2-propenamide IUPAC Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-thiazol-2-yl-acrylamide Formula: C14H10BrN3O3S MolecularWeight: 380.2165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=NC=CS2)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=NC=CS2)Br)O

InChI

InChI=1S/C14H10BrN3O3S/c1-21-11-6-8(5-10(15)12(11)19)4-9(7-16)13(20)18-14-17-2-3-22-14/h2-6,19H,1H3,(H,17,18,20)