2-[2-(2-azanyl-4-chloranyl-7-methyl-pyrrolo[2,3-d]pyrimidin-5-yl)ethoxy]isoindole-1,3-dione

Systemtic Name: 2-[2-(2-azanyl-4-chloranyl-7-methyl-pyrrolo[2,3-d]pyrimidin-5-yl)ethoxy]isoindole-1,3-dione Openeye Name: 2-[2-(2-amino-4-chloro-7-methyl-pyrrolo[2,3-d]pyrimidin-5-yl)ethoxy]isoindoline-1,3-dione CAS Name: 2-[2-(2-amino-4-chloro-7-methyl-5-pyrrolo[2,3-d]pyrimidinyl)ethoxy]isoindole-1,3-dione IUPAC Name: 2-[2-(2-amino-4-chloro-7-methylpyrrolo[2,3-d]pyrimidin-5-yl)ethoxy]isoindole-1,3-dione Traditional Name: 2-[2-(2-amino-4-chloro-7-methyl-pyrrolo[2,3-d]pyrimidin-5-yl)ethoxy]isoindoline-1,3-quinone Formula: C17H14ClN5O3 MolecularWeight: 371.77776

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1N=C(N=C2Cl)N)CCON3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C=C(C2=C1N=C(N=C2Cl)N)CCON3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C17H14ClN5O3/c1-22-8-9(12-13(18)20-17(19)21-14(12)22)6-7-26-23-15(24)10-4-2-3-5-11(10)16(23)25/h2-5,8H,6-7H2,1H3,(H2,19,20,21)