5,7-bis(3-methylphenyl)-N-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,7-bis(3-methylphenyl)-N-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5,7-bis(m-tolyl)-N-tetrahydropyran-4-yl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5,7-bis(3-methylphenyl)-N-(4-oxanyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5,7-bis(3-methylphenyl)-N-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5,7-bis(m-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]-tetrahydropyran-4-yl-amine Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C3=C2N=CN=C3NC4CCOCC4)C5=CC(=CC=C5)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C3=C2N=CN=C3NC4CCOCC4)C5=CC(=CC=C5)C

InChI

InChI=1S/C25H26N4O/c1-17-5-3-7-19(13-17)22-15-29(21-8-4-6-18(2)14-21)25-23(22)24(26-16-27-25)28-20-9-11-30-12-10-20/h3-8,13-16,20H,9-12H2,1-2H3,(H,26,27,28)