N-[[1-(cyclopropylsulfamoyl)-4-(3-fluorophenyl)azepan-4-yl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[1-(cyclopropylsulfamoyl)-4-(3-fluorophenyl)azepan-4-yl]methyl]-2-methoxy-benzamide Openeye Name: N-[[1-(cyclopropylsulfamoyl)-4-(3-fluorophenyl)azepan-4-yl]methyl]-2-methoxy-benzamide CAS Name: N-[[1-(cyclopropylsulfamoyl)-4-(3-fluorophenyl)-4-azepanyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[1-(cyclopropylsulfamoyl)-4-(3-fluorophenyl)azepan-4-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[1-(cyclopropylsulfamoyl)-4-(3-fluorophenyl)azepan-4-yl]methyl]-2-methoxy-benzamide Formula: C24H30FN3O4S MolecularWeight: 475.576103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCCN(CC2)S(=O)(=O)NC3CC3)C4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCCN(CC2)S(=O)(=O)NC3CC3)C4=CC(=CC=C4)F

InChI

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