4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzenesulfonamide

Systemtic Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzenesulfonamide Openeye Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzenesulfonamide CAS Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzenesulfonamide IUPAC Name: 4-[[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzenesulfonamide Traditional Name: 4-[[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzenesulfonamide Formula: C19H18IN3O2S MolecularWeight: 479.33459

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18IN3O2S/c1-13-11-15(14(2)23(13)18-7-3-16(20)4-8-18)12-22-17-5-9-19(10-6-17)26(21,24)25/h3-12H,1-2H3,(H2,21,24,25)