2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methylsulfanyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methylthio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methylsulfanyl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methylthio]-N-(2-thenyl)acetamide Formula: C22H28N4O3S3 MolecularWeight: 492.67772

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSCC(=O)NCC4=CC=CS4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H28N4O3S3/c1-2-26-20-9-8-18(32(28,29)25-10-4-3-5-11-25)13-19(20)24-21(26)15-30-16-22(27)23-14-17-7-6-12-31-17/h6-9,12-13H,2-5,10-11,14-16H2,1H3,(H,23,27)