N-tert-butyl-2-[1-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-[1-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-[1-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[1-[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]-2-benzimidazolyl]thio]acetamide IUPAC Name: N-tert-butyl-2-[1-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-tert-butyl-2-[[1-[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethyl]benzimidazol-2-yl]thio]acetamide Formula: C22H32N4O2S MolecularWeight: 416.58008

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)NC(C)(C)C)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)NC(C)(C)C)C

InChI

InChI=1S/C22H32N4O2S/c1-15-9-8-10-16(2)26(15)20(28)13-25-18-12-7-6-11-17(18)23-21(25)29-14-19(27)24-22(3,4)5/h6-7,11-12,15-16H,8-10,13-14H2,1-5H3,(H,24,27)/t15-,16-/m1/s1