(E)-3-cyclooctyl-2-(4-methylsulfonylphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-cyclooctyl-2-(4-methylsulfonylphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-cyclooctyl-2-(4-methylsulfonylphenyl)-N-thiazol-2-yl-prop-2-enamide CAS Name: (E)-3-cyclooctyl-2-(4-methylsulfonylphenyl)-N-(2-thiazolyl)-2-propenamide IUPAC Name: (E)-3-cyclooctyl-2-(4-methylsulfonylphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-cyclooctyl-2-(4-mesylphenyl)-N-thiazol-2-yl-acrylamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=CC2CCCCCCC2)C(=O)NC3=NC=CS3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)/C(=C\C2CCCCCCC2)/C(=O)NC3=NC=CS3

InChI

InChI=1S/C21H26N2O3S2/c1-28(25,26)18-11-9-17(10-12-18)19(20(24)23-21-22-13-14-27-21)15-16-7-5-3-2-4-6-8-16/h9-16H,2-8H2,1H3,(H,22,23,24)/b19-15+