1-(5-chloranyl-2-oxidanyl-phenyl)-3-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(5-chloranyl-2-oxidanyl-phenyl)-3-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one Openeye Name: 1-(5-chloro-2-hydroxy-phenyl)-3-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one CAS Name: 1-(5-chloro-2-hydroxyphenyl)-3-[(1-methyl-2-benzimidazolyl)thio]-1-propanone IUPAC Name: 1-(5-chloro-2-hydroxyphenyl)-3-(1-methylbenzimidazol-2-yl)sulfanylpropan-1-one Traditional Name: 1-(5-chloro-2-hydroxy-phenyl)-3-[(1-methylbenzimidazol-2-yl)thio]propan-1-one Formula: C17H15ClN2O2S MolecularWeight: 346.8312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCCC(=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCCC(=O)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C17H15ClN2O2S/c1-20-14-5-3-2-4-13(14)19-17(20)23-9-8-16(22)12-10-11(18)6-7-15(12)21/h2-7,10,21H,8-9H2,1H3