(E)-3-(4-bromanylthiophen-2-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(4-bromanylthiophen-2-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-3-(4-bromo-2-thienyl)-2-cyano-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-3-(4-bromo-2-thiophenyl)-2-cyano-N-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-bromothiophen-2-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-bromo-2-thienyl)-2-cyano-N-(4-morpholinophenyl)acrylamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C(=CC3=CC(=CS3)Br)C#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)/C(=C/C3=CC(=CS3)Br)/C#N

InChI

InChI=1S/C18H16BrN3O2S/c19-14-10-17(25-12-14)9-13(11-20)18(23)21-15-1-3-16(4-2-15)22-5-7-24-8-6-22/h1-4,9-10,12H,5-8H2,(H,21,23)/b13-9+