2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C22H33N5O4S2 MolecularWeight: 495.65852

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C22H33N5O4S2/c1-4-27-19-9-8-17(33(30,31)26-12-6-5-7-13-26)14-18(19)24-22(27)32-15-20(28)25-21(29)23-11-10-16(2)3/h8-9,14,16H,4-7,10-13,15H2,1-3H3,(H2,23,25,28,29)