4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethylpyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C=NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C=NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19N3O4S/c1-13-9-15(11-22-16-3-8-19-20(10-16)27-12-26-19)14(2)23(13)17-4-6-18(7-5-17)28(21,24)25/h3-11H,12H2,1-2H3,(H2,21,24,25)