N-[(E)-[1-(4-iodanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]naphthalene-2-sulfonamide

Systemtic Name: N-[(E)-[1-(4-iodanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]naphthalene-2-sulfonamide Openeye Name: N-[(E)-[1-(4-iodo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]naphthalene-2-sulfonamide CAS Name: N-[(E)-[1-(4-iodo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-naphthalenesulfonamide IUPAC Name: N-[(E)-[1-(4-iodo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]naphthalene-2-sulfonamide Traditional Name: N-[(E)-[1-(4-iodo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]naphthalene-2-sulfonamide Formula: C24H22IN3O2S MolecularWeight: 543.41985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)I)C)C)C=NNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)I)C)C)/C=N/NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H22IN3O2S/c1-16-12-22(9-11-24(16)25)28-17(2)13-21(18(28)3)15-26-27-31(29,30)23-10-8-19-6-4-5-7-20(19)14-23/h4-15,27H,1-3H3/b26-15+