N-(3-methylbutylcarbamoyl)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(isoamylcarbamoyl)-2-[(5-morpholinosulfonyl-2-pyridyl)thio]acetamide Formula: C17H26N4O5S2 MolecularWeight: 430.54214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H26N4O5S2/c1-13(2)5-6-18-17(23)20-15(22)12-27-16-4-3-14(11-19-16)28(24,25)21-7-9-26-10-8-21/h3-4,11,13H,5-10,12H2,1-2H3,(H2,18,20,22,23)