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

Systemtic Name: N-(2-cyanoethyl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: N-(2-cyanoethyl)-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-N-(p-tolyl)acetamide CAS Name: N-(2-cyanoethyl)-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: N-(2-cyanoethyl)-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: N-(2-cyanoethyl)-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-N-(p-tolyl)acetamide Formula: C25H29N5O4S2 MolecularWeight: 527.65886

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)N(CCC#N)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)N(CCC#N)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H29N5O4S2/c1-3-29-23-10-9-21(36(32,33)28-13-15-34-16-14-28)17-22(23)27-25(29)35-18-24(31)30(12-4-11-26)20-7-5-19(2)6-8-20/h5-10,17H,3-4,12-16,18H2,1-2H3