N-[4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]phenyl]sulfonylbutanamide

Systemtic Name: N-[4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]phenyl]sulfonylbutanamide Openeye Name: N-[4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]phenyl]sulfonylbutanamide CAS Name: N-[4-[2-[2,4-dimethoxy-5-(1-pyrrolidinyl)phenyl]-1-oxoprop-2-enyl]phenyl]sulfonylbutanamide IUPAC Name: N-[4-[2-(2,4-dimethoxy-5-pyrrolidin-1-ylphenyl)prop-2-enoyl]phenyl]sulfonylbutanamide Traditional Name: N-[4-[2-(2,4-dimethoxy-5-pyrrolidino-phenyl)acryloyl]phenyl]sulfonylbutyramide Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)C(=C)C2=CC(=C(C=C2OC)OC)N3CCCC3

Isomeric SMILES

CCCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)C(=C)C2=CC(=C(C=C2OC)OC)N3CCCC3

InChI

InChI=1S/C25H30N2O6S/c1-5-8-24(28)26-34(30,31)19-11-9-18(10-12-19)25(29)17(2)20-15-21(27-13-6-7-14-27)23(33-4)16-22(20)32-3/h9-12,15-16H,2,5-8,13-14H2,1,3-4H3,(H,26,28)