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

Systemtic Name: (E)-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-[4-(4-bromophenyl)thiazol-2-yl]-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-[4-(4-bromophenyl)-2-thiazolyl]-3-(4-butoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(4-butoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-[4-(4-bromophenyl)thiazol-2-yl]-3-(4-butoxyphenyl)-2-cyano-acrylamide Formula: C23H20BrN3O2S MolecularWeight: 482.3928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H20BrN3O2S/c1-2-3-12-29-20-10-4-16(5-11-20)13-18(14-25)22(28)27-23-26-21(15-30-23)17-6-8-19(24)9-7-17/h4-11,13,15H,2-3,12H2,1H3,(H,26,27,28)/b18-13+