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

Systemtic Name: 2-[2-(4-chloranylphenoxy)ethylsulfanyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(4-chlorophenoxy)ethylthio]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[2-(4-chlorophenoxy)ethylthio]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H17ClN2O2S2 MolecularWeight: 428.95488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCCOC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCCOC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H17ClN2O2S2/c1-13-17(14-5-3-2-4-6-14)18-19(25)23-21(24-20(18)28-13)27-12-11-26-16-9-7-15(22)8-10-16/h2-10H,11-12H2,1H3,(H,23,24,25)