2,5,6-trimethyl-7-(1-phenylethyl)-1H-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2,5,6-trimethyl-7-(1-phenylethyl)-1H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2,5,6-trimethyl-7-(1-phenylethyl)-1H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2,5,6-trimethyl-7-(1-phenylethyl)-1H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2,5,6-trimethyl-7-(1-phenylethyl)-1H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2,5,6-trimethyl-7-(1-phenylethyl)-1H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C17H19N3O MolecularWeight: 281.35226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=O)N=C(N2)C)C(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C2=C1C(=O)N=C(N2)C)C(C)C3=CC=CC=C3)C

InChI

InChI=1S/C17H19N3O/c1-10-11(2)20(12(3)14-8-6-5-7-9-14)16-15(10)17(21)19-13(4)18-16/h5-9,12H,1-4H3,(H,18,19,21)