(phenylmethyl) 2-azanyl-3-(4-phenylphenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: (phenylmethyl) 2-azanyl-3-(4-phenylphenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: benzyl 2-amino-3-(4-phenylbenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-amino-3-[oxo-(4-phenylphenyl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-3-(4-phenylbenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-amino-3-(4-phenylbenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid benzyl ester Formula: C28H24N2O3S MolecularWeight: 468.56676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)N)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)N)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O3S/c29-27-25(26(31)22-13-11-21(12-14-22)20-9-5-2-6-10-20)23-15-16-30(17-24(23)34-27)28(32)33-18-19-7-3-1-4-8-19/h1-14H,15-18,29H2