4-[[3-chloranyl-4-[(R)-cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: 4-[[3-chloranyl-4-[(R)-cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylate Openeye Name: 4-[[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-2-pyrrolecarboxylate IUPAC Name: 4-[[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methylpyrrole-2-carboxylate Traditional Name: 4-[[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]sulfamoyl]-1-methyl-pyrrole-2-carboxylate Formula: C20H15ClN3O4S- MolecularWeight: 428.8688

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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@H](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)/p-1/t17-/m1/s1