3-[2-azanyl-4-bromanyl-7-[(5-methoxy-4,6-dimethyl-pyridin-3-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]prop-2-yn-1-ol

Systemtic Name: 3-[2-azanyl-4-bromanyl-7-[(5-methoxy-4,6-dimethyl-pyridin-3-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]prop-2-yn-1-ol Openeye Name: 3-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethyl-3-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]prop-2-yn-1-ol CAS Name: 3-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-5-pyrrolo[2,3-d]pyrimidinyl]-2-propyn-1-ol IUPAC Name: 3-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethylpyridin-3-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]prop-2-yn-1-ol Traditional Name: 3-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethyl-3-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]prop-2-yn-1-ol Formula: C18H18BrN5O2 MolecularWeight: 416.27182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1CN2C=C(C3=C2N=C(N=C3Br)N)C#CCO)C)OC

Isomeric SMILES

CC1=C(C(=NC=C1CN2C=C(C3=C2N=C(N=C3Br)N)C#CCO)C)OC

InChI

InChI=1S/C18H18BrN5O2/c1-10-13(7-21-11(2)15(10)26-3)9-24-8-12(5-4-6-25)14-16(19)22-18(20)23-17(14)24/h7-8,25H,6,9H2,1-3H3,(H2,20,22,23)