(E)-3-(5-bromanylthiophen-2-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-thienyl)-2-cyano-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-thiophenyl)-2-cyano-N-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-2-cyano-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-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=C(S3)Br)C#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)/C(=C/C3=CC=C(S3)Br)/C#N

InChI

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