2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-N-(2-thenyl)acetamide Formula: C21H26N4O3S3 MolecularWeight: 478.65114

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NCC4=CC=CS4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H26N4O3S3/c1-2-25-19-9-8-17(31(27,28)24-10-4-3-5-11-24)13-18(19)23-21(25)30-15-20(26)22-14-16-7-6-12-29-16/h6-9,12-13H,2-5,10-11,14-15H2,1H3,(H,22,26)