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

Systemtic Name: 3-(4-chloranyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-5-methyl-phenol Openeye Name: 3-(4-chloro-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-5-methyl-phenol CAS Name: 3-(4-chloro-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-5-methylphenol IUPAC Name: 3-(4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl)-5-methylphenol Traditional Name: 3-(4-chloro-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-5-methyl-phenol Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CN(C3=C2C(=NC=N3)Cl)C(C)C)O

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CN(C3=C2C(=NC=N3)Cl)C(C)C)O

InChI

InChI=1S/C16H16ClN3O/c1-9(2)20-7-13(11-4-10(3)5-12(21)6-11)14-15(17)18-8-19-16(14)20/h4-9,21H,1-3H3