(E)-3-(5-bromanylthiophen-2-yl)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-thienyl)-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-thiophenyl)-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-thienyl)-N-(4-methoxy-3-piperidinosulfonyl-phenyl)acrylamide Formula: C19H21BrN2O4S2 MolecularWeight: 485.41504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C=CC2=CC=C(S2)Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC=C(S2)Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H21BrN2O4S2/c1-26-16-8-5-14(21-19(23)10-7-15-6-9-18(20)27-15)13-17(16)28(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23)/b10-7+