N0Z
Summary
Name: | 2,4-bis(azanyl)-9~{H}-pyrimido[4,5-b]indol-6-ol |
Formula: | C10 H9 N5 O |
Formal charge: | 0 |
Formula weight: | 215.211 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2,4-bis(azanyl)-9~{H}-pyrimido[4,5-b]indol-6-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C10H9N5O/c11-8-7-5-3-4(16)1-2-6(5)13-9(7)15-10(12)14-8/h1-3,16H,(H5,11,12,13,14,15) |
InChIKey | InChI | 1.03 | QPHUIBRHCXZODB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1nc(N)c2c([nH]c3ccc(O)cc23)n1 |
SMILES | CACTVS | 3.385 | Nc1nc(N)c2c([nH]c3ccc(O)cc23)n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1O)c3c(nc(nc3[nH]2)N)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1O)c3c(nc(nc3[nH]2)N)N |