4-[2-azanyl-4-chloranyl-7-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[2-azanyl-4-chloranyl-7-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethyl-2-pyridinyl)methyl]-5-pyrrolo[2,3-d]pyrimidinyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethylpyridin-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-but-3-yn-2-ol Formula: C19H19ClIN5O MolecularWeight: 495.74453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1I)C)CN2C=C(C3=C2N=C(N=C3Cl)N)C#CC(C)(C)O

Isomeric SMILES

CC1=CN=C(C(=C1I)C)CN2C=C(C3=C2N=C(N=C3Cl)N)C#CC(C)(C)O

InChI

InChI=1S/C19H19ClIN5O/c1-10-7-23-13(11(2)15(10)21)9-26-8-12(5-6-19(3,4)27)14-16(20)24-18(22)25-17(14)26/h7-8,27H,9H2,1-4H3,(H2,22,24,25)