N-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]piazthiole-4-sulfonamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)CNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)CNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H20N4O3S2/c1-13-11-15(14(2)24(13)16-7-9-17(27-3)10-8-16)12-21-29(25,26)19-6-4-5-18-20(19)23-28-22-18/h4-11,21H,12H2,1-3H3