(E)-3-(3-bromanyl-4,5-dimethoxy-phenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-4,5-dimethoxy-phenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(3-bromo-4,5-dimethoxy-phenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3-bromo-4,5-dimethoxyphenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-4,5-dimethoxyphenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-4,5-dimethoxy-phenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acrylamide Formula: C19H22BrN3O3S MolecularWeight: 452.36528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)NC2=NN=C(S2)C3CCCCC3)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)NC2=NN=C(S2)C3CCCCC3)Br)OC

InChI

InChI=1S/C19H22BrN3O3S/c1-25-15-11-12(10-14(20)17(15)26-2)8-9-16(24)21-19-23-22-18(27-19)13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3,(H,21,23,24)/b9-8+