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

Systemtic Name: 3,3-dimethyl-1-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]butan-2-one Openeye Name: 1-(2-benzylsulfanylbenzimidazol-1-yl)-3,3-dimethyl-butan-2-one CAS Name: 3,3-dimethyl-1-[2-(phenylmethylthio)-1-benzimidazolyl]-2-butanone IUPAC Name: 1-(2-benzylsulfanylbenzimidazol-1-yl)-3,3-dimethylbutan-2-one Traditional Name: 1-[2-(benzylthio)benzimidazol-1-yl]-3,3-dimethyl-butan-2-one Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1SCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1SCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2OS/c1-20(2,3)18(23)13-22-17-12-8-7-11-16(17)21-19(22)24-14-15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3