N-(3-fluoranyl-4-methyl-phenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]propionamide Formula: C20H23FN4O3S2 MolecularWeight: 450.550023

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C)F

InChI

InChI=1S/C20H23FN4O3S2/c1-4-9-25-18-8-7-15(30(22,27)28)11-17(18)24-20(25)29-13(3)19(26)23-14-6-5-12(2)16(21)10-14/h5-8,10-11,13H,4,9H2,1-3H3,(H,23,26)(H2,22,27,28)