N-[5-(3-cyclopentylsulfonylpropanoylamino)-2-methoxy-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[5-(3-cyclopentylsulfonylpropanoylamino)-2-methoxy-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[5-(3-cyclopentylsulfonylpropanoylamino)-2-methoxy-phenyl]-3-fluoro-benzamide CAS Name: N-[5-[(3-cyclopentylsulfonyl-1-oxopropyl)amino]-2-methoxyphenyl]-3-fluorobenzamide IUPAC Name: N-[5-(3-cyclopentylsulfonylpropanoylamino)-2-methoxyphenyl]-3-fluorobenzamide Traditional Name: N-[5-(3-cyclopentylsulfonylpropanoylamino)-2-methoxy-phenyl]-3-fluoro-benzamide Formula: C22H25FN2O5S MolecularWeight: 448.507703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCS(=O)(=O)C2CCCC2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCS(=O)(=O)C2CCCC2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H25FN2O5S/c1-30-20-10-9-17(14-19(20)25-22(27)15-5-4-6-16(23)13-15)24-21(26)11-12-31(28,29)18-7-2-3-8-18/h4-6,9-10,13-14,18H,2-3,7-8,11-12H2,1H3,(H,24,26)(H,25,27)