methyl 5-[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]-3-methyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]-3-methyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-[(E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoyl]-3-methyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 5-[(E)-3-(3-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]-3-methyl-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]-3-methylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 5-[(E)-3-(3-hydroxy-4-methoxy-phenyl)acryloyl]-3-methyl-thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=C(C=C12)C(=O)C=CC3=CC(=C(C=C3)OC)O)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=C(C=C12)C(=O)/C=C/C3=CC(=C(C=C3)OC)O)C(=O)OC

InChI

InChI=1S/C20H17NO5S/c1-11-14-9-13(10-21-19(14)27-18(11)20(24)26-3)15(22)6-4-12-5-7-17(25-2)16(23)8-12/h4-10,23H,1-3H3/b6-4+