3-[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 3-[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 3-(4-benzyloxy-3,5-dichloro-phenyl)-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 3-(3,5-dichloro-4-phenylmethoxyphenyl)-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 3-(3,5-dichloro-4-phenylmethoxyphenyl)-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 3-(4-benzoxy-3,5-dichloro-phenyl)-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C21H12Cl2N2O3S MolecularWeight: 443.30258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C3=CSC4=C3C(=O)C(=C(N4)O)C#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C3=CSC4=C3C(=O)C(=C(N4)O)C#N)Cl

InChI

InChI=1S/C21H12Cl2N2O3S/c22-15-6-12(7-16(23)19(15)28-9-11-4-2-1-3-5-11)14-10-29-21-17(14)18(26)13(8-24)20(27)25-21/h1-7,10H,9H2,(H2,25,26,27)