ethyl 1-ethyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)C3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)C3=C(NC4=CC=CC=C43)C

InChI

InChI=1S/C23H23N3O3S/c1-4-26-19-11-10-15(22(28)29-5-2)12-18(19)25-23(26)30-13-20(27)21-14(3)24-17-9-7-6-8-16(17)21/h6-12,24H,4-5,13H2,1-3H3