4-[2,5-dimethyl-3-(2-piperidin-1-ylethanoyl)pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2,5-dimethyl-3-(2-piperidin-1-ylethanoyl)pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[2,5-dimethyl-3-[2-(1-piperidyl)acetyl]pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[2,5-dimethyl-3-[1-oxo-2-(1-piperidinyl)ethyl]-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[2,5-dimethyl-3-(2-piperidin-1-ylacetyl)pyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[2,5-dimethyl-3-(2-piperidinoacetyl)pyrrol-1-yl]benzenesulfonamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN3CCCCC3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN3CCCCC3

InChI

InChI=1S/C19H25N3O3S/c1-14-12-18(19(23)13-21-10-4-3-5-11-21)15(2)22(14)16-6-8-17(9-7-16)26(20,24)25/h6-9,12H,3-5,10-11,13H2,1-2H3,(H2,20,24,25)