4-[[3-chloranyl-4-[cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[[3-chloranyl-4-[cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-[[3-chloro-4-[cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[[3-chloro-4-[cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[[3-chloro-4-[cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[[3-chloro-4-[cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid Formula: C20H16ClN3O4S MolecularWeight: 429.87674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)C(C#N)C3=CC=CC=C3)Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)C(C#N)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H16ClN3O4S/c1-24-12-15(10-19(24)20(25)26)29(27,28)23-14-7-8-16(18(21)9-14)17(11-22)13-5-3-2-4-6-13/h2-10,12,17,23H,1H3,(H,25,26)