4-[7-(3-methylphenyl)-4-(oxan-4-ylamino)pyrrolo[2,3-d]pyrimidin-5-yl]phenol

Systemtic Name: 4-[7-(3-methylphenyl)-4-(oxan-4-ylamino)pyrrolo[2,3-d]pyrimidin-5-yl]phenol Openeye Name: 4-[7-(m-tolyl)-4-(tetrahydropyran-4-ylamino)pyrrolo[2,3-d]pyrimidin-5-yl]phenol CAS Name: 4-[7-(3-methylphenyl)-4-(4-oxanylamino)-5-pyrrolo[2,3-d]pyrimidinyl]phenol IUPAC Name: 4-[7-(3-methylphenyl)-4-(oxan-4-ylamino)pyrrolo[2,3-d]pyrimidin-5-yl]phenol Traditional Name: 4-[7-(m-tolyl)-4-(tetrahydropyran-4-ylamino)pyrrolo[2,3-d]pyrimidin-5-yl]phenol Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N4O2/c1-16-3-2-4-19(13-16)28-14-21(17-5-7-20(29)8-6-17)22-23(25-15-26-24(22)28)27-18-9-11-30-12-10-18/h2-8,13-15,18,29H,9-12H2,1H3,(H,25,26,27)