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

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-thienyl)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(5-bromo-2-thiophenyl)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-2-propenamide IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(5-bromo-2-thienyl)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-acrylamide Formula: C18H15BrClN3O2S MolecularWeight: 452.7526

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)C(=CC3=CC=C(S3)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrClN3O2S/c19-17-4-2-14(26-17)9-12(11-21)18(24)22-15-10-13(20)1-3-16(15)23-5-7-25-8-6-23/h1-4,9-10H,5-8H2,(H,22,24)/b12-9+