2-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-chloro-7-methyl-2-oxochromen-4-yl)methylsulfanyl]-3-ethyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methylthio]-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H19ClN2O3S2 MolecularWeight: 446.97016

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=CC(=C(C=C34)Cl)C)SC(=C2C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=CC(=C(C=C34)Cl)C)SC(=C2C)C

InChI

InChI=1S/C21H19ClN2O3S2/c1-5-24-20(26)18-11(3)12(4)29-19(18)23-21(24)28-9-13-7-17(25)27-16-6-10(2)15(22)8-14(13)16/h6-8H,5,9H2,1-4H3