1-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-3,3-dimethyl-butan-2-one CAS Name: 1-[2-[(2-chlorophenyl)methylthio]-1-benzimidazolyl]-3,3-dimethyl-2-butanone IUPAC Name: 1-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-3,3-dimethylbutan-2-one Traditional Name: 1-[2-[(2-chlorobenzyl)thio]benzimidazol-1-yl]-3,3-dimethyl-butan-2-one Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1SCC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1SCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN2OS/c1-20(2,3)18(24)12-23-17-11-7-6-10-16(17)22-19(23)25-13-14-8-4-5-9-15(14)21/h4-11H,12-13H2,1-3H3