methyl 3-[[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]methylideneamino]benzoate

Systemtic Name: methyl 3-[[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]methylideneamino]benzoate Openeye Name: methyl 3-[[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]methyleneamino]benzoate CAS Name: 3-[[2,5-dimethyl-1-(4-sulfamoylphenyl)-3-pyrrolyl]methylideneamino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]methylideneamino]benzoate Traditional Name: 3-[[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]methyleneamino]benzoic acid methyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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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(=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4S/c1-14-11-17(13-23-18-6-4-5-16(12-18)21(25)28-3)15(2)24(14)19-7-9-20(10-8-19)29(22,26)27/h4-13H,1-3H3,(H2,22,26,27)