2-[(3,4-dichlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-3-(4-ethoxyphenyl)-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-5,6-dimethyl-3-p-phenetyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H20Cl2N2O2S2 MolecularWeight: 491.4531

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=C(C=C4)Cl)Cl)SC(=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=C(C=C4)Cl)Cl)SC(=C3C)C

InChI

InChI=1S/C23H20Cl2N2O2S2/c1-4-29-17-8-6-16(7-9-17)27-22(28)20-13(2)14(3)31-21(20)26-23(27)30-12-15-5-10-18(24)19(25)11-15/h5-11H,4,12H2,1-3H3