propan-2-yl 6-(1-adamantyl)-3-azanyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: propan-2-yl 6-(1-adamantyl)-3-azanyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: isopropyl 6-(1-adamantyl)-3-amino-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 6-(1-adamantyl)-3-amino-2-thieno[2,3-b]pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-(1-adamantyl)-3-aminothieno[2,3-b]pyridine-2-carboxylate Traditional Name: 6-(1-adamantyl)-3-amino-thieno[2,3-b]pyridine-2-carboxylic acid isopropyl ester Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C2=C(S1)N=C(C=C2)C34CC5CC(C3)CC(C5)C4)N

Isomeric SMILES

CC(C)OC(=O)C1=C(C2=C(S1)N=C(C=C2)C34CC5CC(C3)CC(C5)C4)N

InChI

InChI=1S/C21H26N2O2S/c1-11(2)25-20(24)18-17(22)15-3-4-16(23-19(15)26-18)21-8-12-5-13(9-21)7-14(6-12)10-21/h3-4,11-14H,5-10,22H2,1-2H3