(E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclopropyl-3-[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]acrylamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C=C(C#N)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)/C=C(\C#N)/C(=O)NC4CC4

InChI

InChI=1S/C23H26N4O4S/c1-16-12-18(13-19(15-24)23(28)25-20-6-7-20)17(2)27(16)21-4-3-5-22(14-21)32(29,30)26-8-10-31-11-9-26/h3-5,12-14,20H,6-11H2,1-2H3,(H,25,28)/b19-13+