2-[(4-fluoranylcyclohexyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 2-[(4-fluoranylcyclohexyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 2-[(4-fluorocyclohexyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 2-[(4-fluorocyclohexyl)methylthio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 2-[(4-fluorocyclohexyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 2-[(4-fluorocyclohexyl)methylthio]-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C24H29FN2O3S2 MolecularWeight: 476.627063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4CCC(CC4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4CCC(CC4)F

InChI

InChI=1S/C24H29FN2O3S2/c25-19-9-7-18(8-10-19)17-31-23-6-2-1-5-22(23)24(28)26-20-11-13-21(14-12-20)32(29,30)27-15-3-4-16-27/h1-2,5-6,11-14,18-19H,3-4,7-10,15-17H2,(H,26,28)