(4-chlorophenyl) 4-(methoxymethyl)-6-methyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: (4-chlorophenyl) 4-(methoxymethyl)-6-methyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: (4-chlorophenyl) 4-(methoxymethyl)-6-methyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4-(methoxymethyl)-6-methyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxylic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 4-(methoxymethyl)-6-methyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 4-(methoxymethyl)-6-methyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxylic acid (4-chlorophenyl) ester Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)COC)C(=C(S2)C(=O)OC3=CC=C(C=C3)Cl)N4C=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=C1)COC)C(=C(S2)C(=O)OC3=CC=C(C=C3)Cl)N4C=CC=C4

InChI

InChI=1S/C21H17ClN2O3S/c1-13-11-14(12-26-2)17-18(24-9-3-4-10-24)19(28-20(17)23-13)21(25)27-16-7-5-15(22)6-8-16/h3-11H,12H2,1-2H3