5,6-dimethyl-2-(2-methylpropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(2-methylpropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-isobutylsulfanyl-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-(2-methylpropylthio)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-(2-methylpropylsulfanyl)-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(isobutylthio)-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H20N2OS2 MolecularWeight: 344.4942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2OS2/c1-11(2)10-22-18-19-16-15(12(3)13(4)23-16)17(21)20(18)14-8-6-5-7-9-14/h5-9,11H,10H2,1-4H3