N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(3-fluoro-4-methoxy-benzyl)-N-methyl-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C21H25FN4O4S2 MolecularWeight: 480.576003

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N(C)CC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N(C)CC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H25FN4O4S2/c1-4-9-26-18-7-6-15(32(23,28)29)11-17(18)24-21(26)31-13-20(27)25(2)12-14-5-8-19(30-3)16(22)10-14/h5-8,10-11H,4,9,12-13H2,1-3H3,(H2,23,28,29)