(2S)-1-(3,4-dimethylphenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(3,4-dimethylphenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Openeye Name: (2S)-1-(3,4-dimethylphenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one CAS Name: (2S)-1-(3,4-dimethylphenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-propanone IUPAC Name: (2S)-1-(3,4-dimethylphenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Traditional Name: (2S)-1-(3,4-dimethylphenyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propan-1-one Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NC3=C(N2)C=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[C@H](C)SC2=NC3=C(N2)C=C(C=C3)OC)C

InChI

InChI=1S/C19H20N2O2S/c1-11-5-6-14(9-12(11)2)18(22)13(3)24-19-20-16-8-7-15(23-4)10-17(16)21-19/h5-10,13H,1-4H3,(H,20,21)/t13-/m0/s1