N-(2-cyanoethyl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-methyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-N-methylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-N-methyl-acetamide Formula: C19H25N5O4S2 MolecularWeight: 451.5629

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)N(C)CCC#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)N(C)CCC#N

InChI

InChI=1S/C19H25N5O4S2/c1-3-24-17-6-5-15(30(26,27)23-9-11-28-12-10-23)13-16(17)21-19(24)29-14-18(25)22(2)8-4-7-20/h5-6,13H,3-4,8-12,14H2,1-2H3