methyl 2-chloranyl-3-methyl-7-(phenylmethyl)-5H-thieno[3,4-b]pyridine-7-carboxylate

Systemtic Name: methyl 2-chloranyl-3-methyl-7-(phenylmethyl)-5H-thieno[3,4-b]pyridine-7-carboxylate Openeye Name: methyl 7-benzyl-2-chloro-3-methyl-5H-thieno[3,4-b]pyridine-7-carboxylate CAS Name: 2-chloro-3-methyl-7-(phenylmethyl)-5H-thieno[3,4-b]pyridine-7-carboxylic acid methyl ester IUPAC Name: methyl 7-benzyl-2-chloro-3-methyl-5H-thieno[3,4-b]pyridine-7-carboxylate Traditional Name: 7-benzyl-2-chloro-3-methyl-5H-thieno[3,4-b]pyridine-7-carboxylic acid methyl ester Formula: C17H16ClNO2S MolecularWeight: 333.83244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C(=C1)CSC2(CC3=CC=CC=C3)C(=O)OC)Cl

Isomeric SMILES

CC1=C(N=C2C(=C1)CSC2(CC3=CC=CC=C3)C(=O)OC)Cl

InChI

InChI=1S/C17H16ClNO2S/c1-11-8-13-10-22-17(16(20)21-2,14(13)19-15(11)18)9-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3