tert-butyl 3-azanyl-4-(4-chlorophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: tert-butyl 3-azanyl-4-(4-chlorophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: tert-butyl 3-amino-4-(4-chlorophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4-(4-chlorophenyl)-6-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-4-(4-chlorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4-(4-chlorophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid tert-butyl ester Formula: C24H21ClN2O2S MolecularWeight: 436.95374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C2=C(S1)N=C(C=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C2=C(S1)N=C(C=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)N

InChI

InChI=1S/C24H21ClN2O2S/c1-24(2,3)29-23(28)21-20(26)19-17(14-9-11-16(25)12-10-14)13-18(27-22(19)30-21)15-7-5-4-6-8-15/h4-13H,26H2,1-3H3