2-[3-(4-chloranylphenoxy)propylsulfanyl]-6-methyl-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[3-(4-chloranylphenoxy)propylsulfanyl]-6-methyl-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-6-methyl-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[3-(4-chlorophenoxy)propylthio]-6-methyl-3,5-diphenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-6-methyl-3,5-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[3-(4-chlorophenoxy)propylthio]-6-methyl-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Formula: C28H23ClN2O2S2 MolecularWeight: 519.07742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCCCOC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCCCOC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H23ClN2O2S2/c1-19-24(20-9-4-2-5-10-20)25-26(35-19)30-28(31(27(25)32)22-11-6-3-7-12-22)34-18-8-17-33-23-15-13-21(29)14-16-23/h2-7,9-16H,8,17-18H2,1H3