N-(4-cyclopentylsulfanylphenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[4-(cyclopentylthio)phenyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C22H25FN2O4S2 MolecularWeight: 464.573303

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

InChI

InChI=1S/C22H25FN2O4S2/c23-21-10-9-19(31(27,28)25-11-13-29-14-12-25)15-20(21)22(26)24-16-5-7-18(8-6-16)30-17-3-1-2-4-17/h5-10,15,17H,1-4,11-14H2,(H,24,26)