N-(3-chloranyl-4-methoxy-phenyl)-7-(4-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-7-(4-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-7-(4-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-7-(4-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-[5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C26H21ClN4O MolecularWeight: 440.92414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NC4=CC(=C(C=C4)OC)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NC4=CC(=C(C=C4)OC)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H21ClN4O/c1-17-8-11-20(12-9-17)31-15-21(18-6-4-3-5-7-18)24-25(28-16-29-26(24)31)30-19-10-13-23(32-2)22(27)14-19/h3-16H,1-2H3,(H,28,29,30)