(E)-3-(4-butoxyphenyl)-2-cyano-N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-N-(5-acetyl-4-methyl-thiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(5-acetyl-4-methyl-2-thiazolyl)-3-(4-butoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-3-(4-butoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(5-acetyl-4-methyl-thiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-acrylamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=C(S2)C(=O)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=C(S2)C(=O)C)C

InChI

InChI=1S/C20H21N3O3S/c1-4-5-10-26-17-8-6-15(7-9-17)11-16(12-21)19(25)23-20-22-13(2)18(27-20)14(3)24/h6-9,11H,4-5,10H2,1-3H3,(H,22,23,25)/b16-11+