N-(1-cyano-1-cyclopropyl-ethyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-(1-cyano-1-cyclopropylethyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide IUPAC Name: N-(1-cyano-1-cyclopropylethyl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide Traditional Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC(C)(C#N)C3CC3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC(C)(C#N)C3CC3

InChI

InChI=1S/C16H18N4OS/c1-10-3-6-12-13(7-10)19-15(18-12)22-8-14(21)20-16(2,9-17)11-4-5-11/h3,6-7,11H,4-5,8H2,1-2H3,(H,18,19)(H,20,21)