6-methyl-2-(4-phenoxybutylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-2-(4-phenoxybutylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-(4-phenoxybutylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-(4-phenoxybutylthio)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-2-(4-phenoxybutylsulfanyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-2-(4-phenoxybutylthio)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H22N2O2S2 MolecularWeight: 422.56298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCCCCOC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCCCCOC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O2S2/c1-16-19(17-10-4-2-5-11-17)20-21(26)24-23(25-22(20)29-16)28-15-9-8-14-27-18-12-6-3-7-13-18/h2-7,10-13H,8-9,14-15H2,1H3,(H,24,25,26)