(E)-3-(3-bromanyl-4-oxidanyl-phenyl)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-4-oxidanyl-phenyl)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(3-bromo-4-hydroxy-phenyl)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3-bromo-4-hydroxyphenyl)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-4-hydroxyphenyl)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-4-hydroxy-phenyl)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acrylamide Formula: C14H11BrN4O2S MolecularWeight: 379.23174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C(=CC2=CC(=C(C=C2)O)Br)C#N

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)/C(=C/C2=CC(=C(C=C2)O)Br)/C#N

InChI

InChI=1S/C14H11BrN4O2S/c1-2-12-18-19-14(22-12)17-13(21)9(7-16)5-8-3-4-11(20)10(15)6-8/h3-6,20H,2H2,1H3,(H,17,19,21)/b9-5+