N-[cyclopropyl-[4-(3-fluorophenyl)azepan-4-yl]-sulfamoyl-methyl]-2-methoxy-benzamide

Systemtic Name: N-[cyclopropyl-[4-(3-fluorophenyl)azepan-4-yl]-sulfamoyl-methyl]-2-methoxy-benzamide Openeye Name: N-[cyclopropyl-[4-(3-fluorophenyl)azepan-4-yl]-sulfamoyl-methyl]-2-methoxy-benzamide CAS Name: N-[cyclopropyl-[4-(3-fluorophenyl)-4-azepanyl]-sulfamoylmethyl]-2-methoxybenzamide IUPAC Name: N-[cyclopropyl-[4-(3-fluorophenyl)azepan-4-yl]-sulfamoylmethyl]-2-methoxybenzamide Traditional Name: N-[cyclopropyl-[4-(3-fluorophenyl)azepan-4-yl]-sulfamoyl-methyl]-2-methoxy-benzamide Formula: C24H30FN3O4S MolecularWeight: 475.576103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(C2CC2)(C3(CCCNCC3)C4=CC(=CC=C4)F)S(=O)(=O)N

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(C2CC2)(C3(CCCNCC3)C4=CC(=CC=C4)F)S(=O)(=O)N

InChI

InChI=1S/C24H30FN3O4S/c1-32-21-9-3-2-8-20(21)22(29)28-24(17-10-11-17,33(26,30)31)23(12-5-14-27-15-13-23)18-6-4-7-19(25)16-18/h2-4,6-9,16-17,27H,5,10-15H2,1H3,(H,28,29)(H2,26,30,31)