7-(2-methoxyphenyl)-5-phenyl-4-(phenylmethylsulfanyl)pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(2-methoxyphenyl)-5-phenyl-4-(phenylmethylsulfanyl)pyrrolo[2,3-d]pyrimidine Openeye Name: 4-benzylsulfanyl-7-(2-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(2-methoxyphenyl)-5-phenyl-4-(phenylmethylthio)pyrrolo[2,3-d]pyrimidine IUPAC Name: 4-benzylsulfanyl-7-(2-methoxyphenyl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 4-(benzylthio)-7-(2-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C26H21N3OS MolecularWeight: 423.52944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C3=C2N=CN=C3SCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=C2N=CN=C3SCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3OS/c1-30-23-15-9-8-14-22(23)29-16-21(20-12-6-3-7-13-20)24-25(29)27-18-28-26(24)31-17-19-10-4-2-5-11-19/h2-16,18H,17H2,1H3