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

Systemtic Name: 3,3-dimethyl-1-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-butan-2-one Openeye Name: 1-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-3,3-dimethyl-butan-2-one CAS Name: 1-[[1-(benzenesulfonyl)-2-benzimidazolyl]thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-3,3-dimethylbutan-2-one Traditional Name: 1-[(1-besylbenzimidazol-2-yl)thio]-3,3-dimethyl-butan-2-one Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3S2/c1-19(2,3)17(22)13-25-18-20-15-11-7-8-12-16(15)21(18)26(23,24)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3