ethyl 5-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)SC2=NC3=CC=CC=C3N2CCOC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)SC2=NC3=CC=CC=C3N2CCOC)C

InChI

InChI=1S/C22H27N3O4S/c1-6-29-21(27)18-13(2)19(23-14(18)3)20(26)15(4)30-22-24-16-9-7-8-10-17(16)25(22)11-12-28-5/h7-10,15,23H,6,11-12H2,1-5H3