5-[6-(4-chlorophenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]-2-methoxy-benzenecarbonitrile

Systemtic Name: 5-[6-(4-chlorophenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]-2-methoxy-benzenecarbonitrile Openeye Name: 5-[6-(4-chlorophenyl)-4-oxo-thieno[3,2-d]pyrimidin-3-yl]-2-methoxy-benzonitrile CAS Name: 5-[6-(4-chlorophenyl)-4-oxo-3-thieno[3,2-d]pyrimidinyl]-2-methoxybenzonitrile IUPAC Name: 5-[6-(4-chlorophenyl)-4-oxothieno[3,2-d]pyrimidin-3-yl]-2-methoxybenzonitrile Traditional Name: 5-[6-(4-chlorophenyl)-4-keto-thieno[3,2-d]pyrimidin-3-yl]-2-methoxy-benzonitrile Formula: C20H12ClN3O2S MolecularWeight: 393.84618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=NC3=C(C2=O)SC(=C3)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=NC3=C(C2=O)SC(=C3)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C20H12ClN3O2S/c1-26-17-7-6-15(8-13(17)10-22)24-11-23-16-9-18(27-19(16)20(24)25)12-2-4-14(21)5-3-12/h2-9,11H,1H3