1-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methyl-propan-1-one CAS Name: 1-[4-amino-5-(4-phenoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methylpropan-1-one Traditional Name: 1-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methyl-propan-1-one Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2/c1-14(2)22(27)26-12-18(19-20(23)24-13-25-21(19)26)15-8-10-17(11-9-15)28-16-6-4-3-5-7-16/h3-14H,1-2H3,(H2,23,24,25)