(E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(2,4,5-trimethylphenyl)prop-2-enamide

Systemtic Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(2,4,5-trimethylphenyl)prop-2-enamide Openeye Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(2,4,5-trimethylphenyl)prop-2-enamide CAS Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(2,4,5-trimethylphenyl)-2-propenamide IUPAC Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(2,4,5-trimethylphenyl)prop-2-enamide Traditional Name: (E)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-(2,4,5-trimethylphenyl)acrylamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=CC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1/C=C/C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C)C

InChI

InChI=1S/C20H20N2O3S2/c1-12-9-14(3)15(10-13(12)2)5-8-19(23)22-20-21-17-7-6-16(27(4,24)25)11-18(17)26-20/h5-11H,1-4H3,(H,21,22,23)/b8-5+