5,6-dimethyl-2-phenacylsulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-phenacylsulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-phenacylsulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-(phenacylthio)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-phenacylsulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-(phenacylthio)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H18N2O2S2 MolecularWeight: 406.52052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H18N2O2S2/c1-14-15(2)28-20-19(14)21(26)24(17-11-7-4-8-12-17)22(23-20)27-13-18(25)16-9-5-3-6-10-16/h3-12H,13H2,1-2H3