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

Systemtic Name: (E)-3-(3-methylthiophen-2-yl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-3-(3-methyl-2-thienyl)-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-3-(3-methyl-2-thiophenyl)-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-methylthiophen-2-yl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(3-methyl-2-thienyl)-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)acrylamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

CC1=C(SC=C1)/C=C/C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C22H27N3O4S2/c1-17-8-15-30-21(17)6-7-22(26)23-19-16-18(4-5-20(19)24-9-2-3-10-24)31(27,28)25-11-13-29-14-12-25/h4-8,15-16H,2-3,9-14H2,1H3,(H,23,26)/b7-6+