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

Systemtic Name: tert-butyl 3-azanyl-4-(4-chlorophenyl)-6-thiophen-2-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: tert-butyl 3-amino-4-(4-chlorophenyl)-6-(2-thienyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4-(4-chlorophenyl)-6-thiophen-2-yl-2-thieno[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-4-(4-chlorophenyl)-6-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4-(4-chlorophenyl)-6-(2-thienyl)thieno[2,3-b]pyridine-2-carboxylic acid tert-butyl ester Formula: C22H19ClN2O2S2 MolecularWeight: 442.98146

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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=CS4)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C2=C(S1)N=C(C=C2C3=CC=C(C=C3)Cl)C4=CC=CS4)N

InChI

InChI=1S/C22H19ClN2O2S2/c1-22(2,3)27-21(26)19-18(24)17-14(12-6-8-13(23)9-7-12)11-15(25-20(17)29-19)16-5-4-10-28-16/h4-11H,24H2,1-3H3