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

Systemtic Name: 4-[2-azanyl-4-bromanyl-7-[(5-methoxy-4,6-dimethyl-pyridin-3-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]but-3-yn-1-ol Openeye Name: 4-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethyl-3-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]but-3-yn-1-ol CAS Name: 4-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-5-pyrrolo[2,3-d]pyrimidinyl]-3-butyn-1-ol IUPAC Name: 4-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethylpyridin-3-yl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]but-3-yn-1-ol Traditional Name: 4-[2-amino-4-bromo-7-[(5-methoxy-4,6-dimethyl-3-pyridyl)methyl]pyrrolo[2,3-d]pyrimidin-5-yl]but-3-yn-1-ol Formula: C19H20BrN5O2 MolecularWeight: 430.2984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN5O2/c1-11-14(8-22-12(2)16(11)27-3)10-25-9-13(6-4-5-7-26)15-17(20)23-19(21)24-18(15)25/h8-9,26H,5,7,10H2,1-3H3,(H2,21,23,24)