2-[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[7-(3-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[7-(3-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Formula: C28H24N4 MolecularWeight: 416.51696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C3=C2N=CN=C3N4CCC5=CC=CC=C5C4)C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C3=C2N=CN=C3N4CCC5=CC=CC=C5C4)C6=CC=CC=C6

InChI

InChI=1S/C28H24N4/c1-20-8-7-13-24(16-20)32-18-25(22-10-3-2-4-11-22)26-27(29-19-30-28(26)32)31-15-14-21-9-5-6-12-23(21)17-31/h2-13,16,18-19H,14-15,17H2,1H3