(E)-3-(5-bromanylthiophen-2-yl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-yl-ethyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-yl-ethyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-thienyl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholino-ethyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-thiophenyl)-N-[2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholinyl)ethyl]-2-propenamide IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-N-[2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ylethyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-thienyl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholino-ethyl]acrylamide Formula: C22H27BrN2O4S MolecularWeight: 495.42978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC(=O)C=CC2=CC=C(S2)Br)N3CCOCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(CNC(=O)/C=C/C2=CC=C(S2)Br)N3CCOCC3)OC

InChI

InChI=1S/C22H27BrN2O4S/c1-3-29-19-7-4-16(14-20(19)27-2)18(25-10-12-28-13-11-25)15-24-22(26)9-6-17-5-8-21(23)30-17/h4-9,14,18H,3,10-13,15H2,1-2H3,(H,24,26)/b9-6+