1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone Openeye Name: 1-[(2S,6S)-2,6-dimethyl-1-piperidyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone CAS Name: 1-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]ethanone IUPAC Name: 1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone Traditional Name: 1-[(2S,6S)-2,6-dimethylpiperidino]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]ethanone Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC3=C(N2)C=C(C=C3)C)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)CSC2=NC3=C(N2)C=C(C=C3)C)C

InChI

InChI=1S/C17H23N3OS/c1-11-7-8-14-15(9-11)19-17(18-14)22-10-16(21)20-12(2)5-4-6-13(20)3/h7-9,12-13H,4-6,10H2,1-3H3,(H,18,19)/t12-,13-/m0/s1