2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-N-(4-fluorobenzyl)acetamide Formula: C22H25FN4O4S2 MolecularWeight: 492.586703

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H25FN4O4S2/c1-2-27-20-8-7-18(33(29,30)26-9-11-31-12-10-26)13-19(20)25-22(27)32-15-21(28)24-14-16-3-5-17(23)6-4-16/h3-8,13H,2,9-12,14-15H2,1H3,(H,24,28)