3-butyl-2-[(2-methylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-butyl-2-[(2-methylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-butyl-2-(o-tolylmethylsulfanyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 3-butyl-2-[(2-methylphenyl)methylthio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-butyl-2-[(2-methylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-butyl-2-[(2-methylbenzyl)thio]thieno[3,2-d]pyrimidin-4-one Formula: C18H20N2OS2 MolecularWeight: 344.4942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=CS2)N=C1SCC3=CC=CC=C3C

Isomeric SMILES

CCCCN1C(=O)C2=C(C=CS2)N=C1SCC3=CC=CC=C3C

InChI

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