2-[[4-(4-hydroxyphenyl)carbonylphenyl]methylsulfanyl]-3,5-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(4-hydroxyphenyl)carbonylphenyl]methylsulfanyl]-3,5-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-(4-hydroxybenzoyl)phenyl]methylsulfanyl]-3,5-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-[(4-hydroxyphenyl)-oxomethyl]phenyl]methylthio]-3,5-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[[4-(4-hydroxybenzoyl)phenyl]methylsulfanyl]-3,5-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-(4-hydroxybenzoyl)benzyl]thio]-3,5-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)O)C

Isomeric SMILES

CC1=CSC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)O)C

InChI

InChI=1S/C22H18N2O3S2/c1-13-11-28-20-18(13)21(27)24(2)22(23-20)29-12-14-3-5-15(6-4-14)19(26)16-7-9-17(25)10-8-16/h3-11,25H,12H2,1-2H3