ethyl 1-ethyl-2-[2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-[(2R)-2-methylindolin-1-yl]-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-keto-2-[(2R)-2-methylindolin-1-yl]ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)N3C(CC4=CC=CC=C43)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)N3[C@@H](CC4=CC=CC=C43)C

InChI

InChI=1S/C23H25N3O3S/c1-4-25-20-11-10-17(22(28)29-5-2)13-18(20)24-23(25)30-14-21(27)26-15(3)12-16-8-6-7-9-19(16)26/h6-11,13,15H,4-5,12,14H2,1-3H3/t15-/m1/s1