2-bromanyl-N-(3-chloranyl-4-cyano-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(3-chloranyl-4-cyano-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(3-chloro-4-cyano-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-(3-chloro-4-cyanophenyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(3-chloro-4-cyanophenyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(3-chloro-4-cyano-phenyl)-5-pyrrolidinosulfonyl-benzamide Formula: C18H15BrClN3O3S MolecularWeight: 468.752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H15BrClN3O3S/c19-16-6-5-14(27(25,26)23-7-1-2-8-23)10-15(16)18(24)22-13-4-3-12(11-21)17(20)9-13/h3-6,9-10H,1-2,7-8H2,(H,22,24)