N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(2-hexylsulfanylbenzimidazol-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(2-hexylsulfanylbenzimidazol-1-yl)ethanamide Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(2-hexylsulfanylbenzimidazol-1-yl)acetamide CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-[2-(hexylthio)-1-benzimidazolyl]acetamide IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-(2-hexylsulfanylbenzimidazol-1-yl)acetamide Traditional Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-[2-(hexylthio)benzimidazol-1-yl]acetamide Formula: C25H31ClN4O4S2 MolecularWeight: 551.12104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

CCCCCCSC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C25H31ClN4O4S2/c1-2-3-4-7-16-35-25-28-21-8-5-6-9-23(21)30(25)18-24(31)27-22-17-19(10-11-20(22)26)36(32,33)29-12-14-34-15-13-29/h5-6,8-11,17H,2-4,7,12-16,18H2,1H3,(H,27,31)