ethyl 1-ethyl-2-[2-[(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-[(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-(4-methyl-2-morpholinosulfonyl-anilino)-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-[4-methyl-2-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-(4-methyl-2-morpholin-4-ylsulfonylanilino)-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-keto-2-(4-methyl-2-morpholinosulfonyl-anilino)ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C25H30N4O6S2 MolecularWeight: 546.6589

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC3=C(C=C(C=C3)C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC3=C(C=C(C=C3)C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H30N4O6S2/c1-4-29-21-9-7-18(24(31)35-5-2)15-20(21)27-25(29)36-16-23(30)26-19-8-6-17(3)14-22(19)37(32,33)28-10-12-34-13-11-28/h6-9,14-15H,4-5,10-13,16H2,1-3H3,(H,26,30)