cyclohexyl 3-azanyl-4,6-bis(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: cyclohexyl 3-azanyl-4,6-bis(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: cyclohexyl 3-amino-4,6-bis(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4,6-bis(4-chlorophenyl)-2-thieno[2,3-b]pyridinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-amino-4,6-bis(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4,6-bis(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxylic acid cyclohexyl ester Formula: C26H22Cl2N2O2S MolecularWeight: 497.43608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=C(C3=C(S2)N=C(C=C3C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl)N

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=C(C3=C(S2)N=C(C=C3C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl)N

InChI

InChI=1S/C26H22Cl2N2O2S/c27-17-10-6-15(7-11-17)20-14-21(16-8-12-18(28)13-9-16)30-25-22(20)23(29)24(33-25)26(31)32-19-4-2-1-3-5-19/h6-14,19H,1-5,29H2