4-[2,5-dimethyl-3-[(2-sulfanylphenyl)iminomethyl]pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2,5-dimethyl-3-[(2-sulfanylphenyl)iminomethyl]pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[2,5-dimethyl-3-[(2-sulfanylphenyl)iminomethyl]pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[3-[(2-mercaptophenyl)iminomethyl]-2,5-dimethyl-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[2,5-dimethyl-3-[(2-sulfanylphenyl)iminomethyl]pyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[(2-mercaptophenyl)iminomethyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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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=CC=CC=C3S

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C=NC3=CC=CC=C3S

InChI

InChI=1S/C19H19N3O2S2/c1-13-11-15(12-21-18-5-3-4-6-19(18)25)14(2)22(13)16-7-9-17(10-8-16)26(20,23)24/h3-12,25H,1-2H3,(H2,20,23,24)