1-[4-[3-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[4-[3-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[3-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[4-[3-[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]-2-hydroxypropoxy]phenyl]ethanone IUPAC Name: 1-[4-[3-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-2-hydroxypropoxy]phenyl]ethanone Traditional Name: 1-[4-[3-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]-2-hydroxy-propoxy]phenyl]ethanone Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(CSC2=NC3=C(N2CCOC)C=CC(=C3)Cl)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(CSC2=NC3=C(N2CCOC)C=CC(=C3)Cl)O

InChI

InChI=1S/C21H23ClN2O4S/c1-14(25)15-3-6-18(7-4-15)28-12-17(26)13-29-21-23-19-11-16(22)5-8-20(19)24(21)9-10-27-2/h3-8,11,17,26H,9-10,12-13H2,1-2H3