4-[2,5-dimethyl-3-[2-(phenylmethyl)-1,3-thiazol-4-yl]pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2,5-dimethyl-3-[2-(phenylmethyl)-1,3-thiazol-4-yl]pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[3-(2-benzylthiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[2,5-dimethyl-3-[2-(phenylmethyl)-4-thiazolyl]-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[3-(2-benzyl-1,3-thiazol-4-yl)-2,5-dimethylpyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-(2-benzylthiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C3=CSC(=N3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C3=CSC(=N3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S2/c1-15-12-20(21-14-28-22(24-21)13-17-6-4-3-5-7-17)16(2)25(15)18-8-10-19(11-9-18)29(23,26)27/h3-12,14H,13H2,1-2H3,(H2,23,26,27)