tert-butyl 2-azanyl-6-[2-(4-phenylmethoxyphenyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: tert-butyl 2-azanyl-6-[2-(4-phenylmethoxyphenyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: tert-butyl 2-amino-6-[2-(4-benzyloxyphenyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-amino-6-[2-(4-phenylmethoxyphenyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-6-[2-(4-phenylmethoxyphenyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-amino-6-[2-(4-benzoxyphenyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester Formula: C27H32N2O3S MolecularWeight: 464.61958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(SC2=C1CCN(C2)CCC3=CC=C(C=C3)OCC4=CC=CC=C4)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(SC2=C1CCN(C2)CCC3=CC=C(C=C3)OCC4=CC=CC=C4)N

InChI

InChI=1S/C27H32N2O3S/c1-27(2,3)32-26(30)24-22-14-16-29(17-23(22)33-25(24)28)15-13-19-9-11-21(12-10-19)31-18-20-7-5-4-6-8-20/h4-12H,13-18,28H2,1-3H3