977
Summary
Name: | 2-AMINO-5-BROMO-6-PHENYLPYRIMIDIN-4-OL |
Formula: | C10 H8 Br N3 O |
Formal charge: | 0 |
Formula weight: | 266.094 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 2-amino-5-bromo-6-phenylpyrimidin-4-ol |
OpenEye OEToolkits | 1.5.0 | 2-amino-5-bromo-6-phenyl-pyrimidin-4-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Brc2c(O)nc(nc2c1ccccc1)N |
SMILES_CANONICAL | CACTVS | 3.341 | Nc1nc(O)c(Br)c(n1)c2ccccc2 |
SMILES | CACTVS | 3.341 | Nc1nc(O)c(Br)c(n1)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2c(c(nc(n2)N)O)Br |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2c(c(nc(n2)N)O)Br |
InChI | InChI | 1.03 | InChI=1S/C10H8BrN3O/c11-7-8(6-4-2-1-3-5-6)13-10(12)14-9(7)15/h1-5H,(H3,12,13,14,15) |
InChIKey | InChI | 1.03 | CIUUIPMOFZIWIZ-UHFFFAOYSA-N |