(E)-2-cyano-3-(4-methoxyphenyl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)acrylamide Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C25H28N4O5S/c1-33-21-6-4-19(5-7-21)16-20(18-26)25(30)27-23-17-22(8-9-24(23)28-10-2-3-11-28)35(31,32)29-12-14-34-15-13-29/h4-9,16-17H,2-3,10-15H2,1H3,(H,27,30)/b20-16+