5-(azepan-1-ylsulfonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(4-fluorophenyl)ethyl]-2-methoxy-benzamide Formula: C22H27FN2O4S MolecularWeight: 434.524183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2O4S/c1-29-21-11-10-19(30(27,28)25-14-4-2-3-5-15-25)16-20(21)22(26)24-13-12-17-6-8-18(23)9-7-17/h6-11,16H,2-5,12-15H2,1H3,(H,24,26)