2-chloranyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[3-(2-pyridin-2-ylethynyl)phenyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]-5-pyrrolidinosulfonyl-benzamide Formula: C24H20ClN3O3S MolecularWeight: 465.9519

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

InChI

InChI=1S/C24H20ClN3O3S/c25-23-12-11-21(32(30,31)28-14-3-4-15-28)17-22(23)24(29)27-20-8-5-6-18(16-20)9-10-19-7-1-2-13-26-19/h1-2,5-8,11-13,16-17H,3-4,14-15H2,(H,27,29)