3-[4-[(phenylmethyl)amino]-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl]phenol

Systemtic Name: 3-[4-[(phenylmethyl)amino]-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl]phenol Openeye Name: 3-[4-(benzylamino)-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl]phenol CAS Name: 3-[4-[(phenylmethyl)amino]-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl]phenol IUPAC Name: 3-[4-(benzylamino)-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl]phenol Traditional Name: 3-[4-(benzylamino)-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl]phenol Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2NCC3=CC=CC=C3)C4=CC(=CC=C4)O

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2NCC3=CC=CC=C3)C4=CC(=CC=C4)O

InChI

InChI=1S/C22H22N4O/c1-15(2)26-13-19(17-9-6-10-18(27)11-17)20-21(24-14-25-22(20)26)23-12-16-7-4-3-5-8-16/h3-11,13-15,27H,12H2,1-2H3,(H,23,24,25)