5-methyl-2-(2-oxidanylidenepropylsulfanyl)-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-methyl-2-(2-oxidanylidenepropylsulfanyl)-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-5-methyl-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-2-(2-oxopropylthio)-3,6-diphenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-2-(2-oxopropylsulfanyl)-3,6-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(acetonylthio)-5-methyl-3,6-diphenyl-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)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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