AJZ
Summary
Name: | 3-(4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)phenol |
Formula: | C16 H15 N3 O2 S |
Formal charge: | 0 |
Formula weight: | 313.374 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | 3-(4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | Oc1cccc(c1)c2nc3ccsc3c(n2)N4CCOCC4 |
SMILES | CACTVS | 3.352 | Oc1cccc(c1)c2nc3ccsc3c(n2)N4CCOCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(cc(c1)O)c2nc3ccsc3c(n2)N4CCOCC4 |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(cc(c1)O)c2nc3ccsc3c(n2)N4CCOCC4 |
InChI | InChI | 1.03 | InChI=1S/C16H15N3O2S/c20-12-3-1-2-11(10-12)15-17-13-4-9-22-14(13)16(18-15)19-5-7-21-8-6-19/h1-4,9-10,20H,5-8H2 |
InChIKey | InChI | 1.03 | XXLAEKOWCYJOKK-UHFFFAOYSA-N |