N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[(1-ethyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-(1-ethyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C17H21N5O3S2 MolecularWeight: 407.51034

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC(C)(C#N)C3CC3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N[C@](C)(C#N)C3CC3

InChI

InChI=1S/C17H21N5O3S2/c1-3-22-14-7-6-12(27(19,24)25)8-13(14)20-16(22)26-9-15(23)21-17(2,10-18)11-4-5-11/h6-8,11H,3-5,9H2,1-2H3,(H,21,23)(H2,19,24,25)/t17-/m1/s1