(E)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)prop-2-enamide CAS Name: (E)-N-[4-(3-bromophenyl)-2-thiazolyl]-2-cyano-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)acrylamide Formula: C22H18BrN3O2S MolecularWeight: 468.36622

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H18BrN3O2S/c1-2-10-28-19-8-6-15(7-9-19)11-17(13-24)21(27)26-22-25-20(14-29-22)16-4-3-5-18(23)12-16/h3-9,11-12,14H,2,10H2,1H3,(H,25,26,27)/b17-11+