N-[3-cyano-4-[1-[5-(4-methoxyphenyl)carbonyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide

Systemtic Name: N-[3-cyano-4-[1-[5-(4-methoxyphenyl)carbonyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Openeye Name: N-[3-cyano-4-[1-[5-(4-methoxybenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide CAS Name: N-[3-cyano-4-[1-[5-[(4-methoxyphenyl)-oxomethyl]-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[3-cyano-4-[1-[5-(4-methoxybenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Traditional Name: N-[3-cyano-4-[1-(5-p-anisoyl-1H-pyrrol-2-yl)ethyl]phenyl]methanesulfonamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)NS(=O)(=O)C)C#N)C2=CC=C(N2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C1=C(C=C(C=C1)NS(=O)(=O)C)C#N)C2=CC=C(N2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21N3O4S/c1-14(19-9-6-17(12-16(19)13-23)25-30(3,27)28)20-10-11-21(24-20)22(26)15-4-7-18(29-2)8-5-15/h4-12,14,24-25H,1-3H3