3-chloranyl-4-fluoranyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-4-fluoro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-4-fluoro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-4-fluoro-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-4-fluoro-N-(4-pyrrolidinosulfonylphenyl)benzothiophene-2-carboxamide Formula: C19H16ClFN2O3S2 MolecularWeight: 438.923343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(C=CC=C4S3)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(C=CC=C4S3)F)Cl

InChI

InChI=1S/C19H16ClFN2O3S2/c20-17-16-14(21)4-3-5-15(16)27-18(17)19(24)22-12-6-8-13(9-7-12)28(25,26)23-10-1-2-11-23/h3-9H,1-2,10-11H2,(H,22,24)