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

Systemtic Name: 5-ethyl-6-methyl-3-(3-methylphenyl)-2-(2-oxidanylidenepropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-5-ethyl-6-methyl-3-(m-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-3-(3-methylphenyl)-2-(2-oxopropylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-ethyl-6-methyl-3-(3-methylphenyl)-2-(2-oxopropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(acetonylthio)-5-ethyl-6-methyl-3-(m-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C)C3=CC=CC(=C3)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C)C3=CC=CC(=C3)C)C

InChI

InChI=1S/C19H20N2O2S2/c1-5-15-13(4)25-17-16(15)18(23)21(14-8-6-7-11(2)9-14)19(20-17)24-10-12(3)22/h6-9H,5,10H2,1-4H3