ethyl 5-chloranyl-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 5-chloro-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 5-chloro-4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 5-chloro-4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C16H15ClN2O2S MolecularWeight: 334.8205

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)Cl)C)N3C=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)Cl)C)N3C=CC=C3

InChI

InChI=1S/C16H15ClN2O2S/c1-4-21-16(20)14-13(19-7-5-6-8-19)11-9(2)12(17)10(3)18-15(11)22-14/h5-8H,4H2,1-3H3