(2S)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: (2S)-2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-2-phenyl-acetamide CAS Name: (2S)-2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-2-phenylacetamide IUPAC Name: (2S)-2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-2-phenylacetamide Traditional Name: (2S)-2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-2-phenyl-acetamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SC(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1S[C@@H](C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H26N4O3S2/c1-2-26-19-12-11-17(31(28,29)25-13-7-4-8-14-25)15-18(19)24-22(26)30-20(21(23)27)16-9-5-3-6-10-16/h3,5-6,9-12,15,20H,2,4,7-8,13-14H2,1H3,(H2,23,27)/t20-/m0/s1