methyl 2-[(4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methyl]benzoate

Systemtic Name: methyl 2-[(4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methyl]benzoate Openeye Name: methyl 2-[(4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methyl]benzoate CAS Name: 2-[(4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methyl]benzoate Traditional Name: 2-[(4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)methyl]benzoic acid methyl ester Formula: C22H21NO2S MolecularWeight: 363.47264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CN2CC(C3=C(C2)SC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1CN2CC(C3=C(C2)SC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21NO2S/c1-25-22(24)18-10-6-5-9-17(18)13-23-14-20(16-7-3-2-4-8-16)19-11-12-26-21(19)15-23/h2-12,20H,13-15H2,1H3