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

Systemtic Name: tert-butyl 2-azanyl-6-(3,3-diphenylpropyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: tert-butyl 2-amino-6-(3,3-diphenylpropyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-amino-6-(3,3-diphenylpropyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-6-(3,3-diphenylpropyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-amino-6-(3,3-diphenylpropyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester Formula: C27H32N2O2S MolecularWeight: 448.62018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N2O2S/c1-27(2,3)31-26(30)24-22-15-17-29(18-23(22)32-25(24)28)16-14-21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21H,14-18,28H2,1-3H3