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

Systemtic Name: 5-[2-azanyl-4-chloranyl-7-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-pent-4-yn-2-ol Openeye Name: 5-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-pent-4-yn-2-ol CAS Name: 5-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethyl-2-pyridinyl)methyl]-5-pyrrolo[2,3-d]pyrimidinyl]-2-methyl-4-pentyn-2-ol IUPAC Name: 5-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethylpyridin-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylpent-4-yn-2-ol Traditional Name: 5-[2-amino-4-chloro-7-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methyl-pent-4-yn-2-ol Formula: C20H21ClIN5O MolecularWeight: 509.77111

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClIN5O/c1-11-8-24-14(12(2)16(11)22)10-27-9-13(6-5-7-20(3,4)28)15-17(21)25-19(23)26-18(15)27/h8-9,28H,7,10H2,1-4H3,(H2,23,25,26)