2-(2-oxidanylidenepropylsulfanyl)-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(2-oxidanylidenepropylsulfanyl)-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-5-(4-isopropylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(2-oxopropylthio)-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(2-oxopropylsulfanyl)-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(acetonylthio)-5-p-cumenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)C

InChI

InChI=1S/C18H18N2O2S2/c1-10(2)12-4-6-13(7-5-12)14-9-23-17-15(14)16(22)19-18(20-17)24-8-11(3)21/h4-7,9-10H,8H2,1-3H3,(H,19,20,22)