ethyl 1-ethyl-2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 2-[(2-cumidino-2-keto-ethyl)thio]-1-ethyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3S/c1-5-26-20-12-9-17(22(28)29-6-2)13-19(20)25-23(26)30-14-21(27)24-18-10-7-16(8-11-18)15(3)4/h7-13,15H,5-6,14H2,1-4H3,(H,24,27)