3-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-methylsulfonyl-1-(4-oxidanylcyclohexyl)benzimidazol-2-one

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-methylsulfonyl-1-(4-oxidanylcyclohexyl)benzimidazol-2-one Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-(4-hydroxycyclohexyl)-5-methylsulfonyl-benzimidazol-2-one CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(4-hydroxycyclohexyl)-5-methylsulfonyl-2-benzimidazolone IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(4-hydroxycyclohexyl)-5-methylsulfonylbenzimidazol-2-one Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-(4-hydroxycyclohexyl)-5-mesyl-benzimidazol-2-one Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)S(=O)(=O)C)N(C2=O)C4CCC(CC4)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)S(=O)(=O)C)N(C2=O)C4CCC(CC4)O)Cl

InChI

InChI=1S/C22H25ClN2O5S/c1-30-21-10-3-14(11-18(21)23)13-24-20-12-17(31(2,28)29)8-9-19(20)25(22(24)27)15-4-6-16(26)7-5-15/h3,8-12,15-16,26H,4-7,13H2,1-2H3