2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-3-ethyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-ethyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H17ClN2O2S2 MolecularWeight: 440.96558

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)Cl)SC=C2C4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)Cl)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C22H17ClN2O2S2/c1-2-25-21(27)19-17(14-6-4-3-5-7-14)12-28-20(19)24-22(25)29-13-18(26)15-8-10-16(23)11-9-15/h3-12H,2,13H2,1H3