4-azanyl-2-[5-chloranyl-3-(3,3-dimethylbutyl)indazol-1-yl]-5-ethyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-one

Systemtic Name: 4-azanyl-2-[5-chloranyl-3-(3,3-dimethylbutyl)indazol-1-yl]-5-ethyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-one Openeye Name: 4-amino-2-[5-chloro-3-(3,3-dimethylbutyl)indazol-1-yl]-5-ethyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-one CAS Name: 4-amino-2-[5-chloro-3-(3,3-dimethylbutyl)-1-indazolyl]-5-ethyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-one IUPAC Name: 4-amino-2-[5-chloro-3-(3,3-dimethylbutyl)indazol-1-yl]-5-ethyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-one Traditional Name: 4-amino-2-[5-chloro-3-(3,3-dimethylbutyl)indazol-1-yl]-5-ethyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-one Formula: C22H27ClN6O MolecularWeight: 426.94238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(NC1=O)N=C(N=C2N)N3C4=C(C=C(C=C4)Cl)C(=N3)CCC(C)(C)C)C

Isomeric SMILES

CCC1(C2=C(NC1=O)N=C(N=C2N)N3C4=C(C=C(C=C4)Cl)C(=N3)CCC(C)(C)C)C

InChI

InChI=1S/C22H27ClN6O/c1-6-22(5)16-17(24)25-20(27-18(16)26-19(22)30)29-15-8-7-12(23)11-13(15)14(28-29)9-10-21(2,3)4/h7-8,11H,6,9-10H2,1-5H3,(H3,24,25,26,27,30)