3-[[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]propan-1-ol

Systemtic Name: 3-[[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]propan-1-ol Openeye Name: 3-[[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]propan-1-ol CAS Name: 3-[[7-(3-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]amino]-1-propanol IUPAC Name: 3-[[7-(3-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]amino]propan-1-ol Traditional Name: 3-[[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]propan-1-ol Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C3=C2N=CN=C3NCCCO)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C3=C2N=CN=C3NCCCO)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O/c1-16-7-5-10-18(13-16)26-14-19(17-8-3-2-4-9-17)20-21(23-11-6-12-27)24-15-25-22(20)26/h2-5,7-10,13-15,27H,6,11-12H2,1H3,(H,23,24,25)