4-[4-(4-chloranylphenoxy)butylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[4-(4-chloranylphenoxy)butylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-(4-chlorophenoxy)butylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidine CAS Name: 4-[4-(4-chlorophenoxy)butylthio]-6-phenylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-(4-chlorophenoxy)butylsulfanyl]-6-phenylthieno[2,3-d]pyrimidine Traditional Name: 4-[4-(4-chlorophenoxy)butylthio]-6-phenyl-thieno[2,3-d]pyrimidine Formula: C22H19ClN2OS2 MolecularWeight: 426.98206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCCCCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCCCCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN2OS2/c23-17-8-10-18(11-9-17)26-12-4-5-13-27-21-19-14-20(16-6-2-1-3-7-16)28-22(19)25-15-24-21/h1-3,6-11,14-15H,4-5,12-13H2