7-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(4-methoxyphenyl)-N-[2-(methylthio)phenyl]-5-phenyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-[2-(methylthio)phenyl]amine Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NC4=CC=CC=C4SC)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NC4=CC=CC=C4SC)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4OS/c1-31-20-14-12-19(13-15-20)30-16-21(18-8-4-3-5-9-18)24-25(27-17-28-26(24)30)29-22-10-6-7-11-23(22)32-2/h3-17H,1-2H3,(H,27,28,29)