methyl 3-acetamido-6-(4-bromophenyl)-4-methyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-acetamido-6-(4-bromophenyl)-4-methyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-acetamido-6-(4-bromophenyl)-4-methyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-acetamido-6-(4-bromophenyl)-4-methyl-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-acetamido-6-(4-bromophenyl)-4-methylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-acetamido-6-(4-bromophenyl)-4-methyl-thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)OC)NC(=O)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)OC)NC(=O)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H15BrN2O3S/c1-9-8-13(11-4-6-12(19)7-5-11)21-17-14(9)15(20-10(2)22)16(25-17)18(23)24-3/h4-8H,1-3H3,(H,20,22)