2T0
Summary
| Name: | 2-amino-4,5-dihydronaphtho[1,2-d][1,3]thiazol-8-yl dihydrogen phosphate |
| Formula: | C11 H11 N2 O4 P S |
| Formal charge: | 0 |
| Formula weight: | 298.255 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-amino-4,5-dihydronaphtho[1,2-d][1,3]thiazol-8-yl dihydrogen phosphate |
| OpenEye OEToolkits | 1.5.0 | (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-8-yl) dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)Oc3ccc2c(c1nc(sc1CC2)N)c3 |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1sc2CCc3ccc(O[P](O)(O)=O)cc3c2n1 |
| SMILES | CACTVS | 3.341 | Nc1sc2CCc3ccc(O[P](O)(O)=O)cc3c2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1OP(=O)(O)O)-c3c(sc(n3)N)CC2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1OP(=O)(O)O)-c3c(sc(n3)N)CC2 |
| InChI | InChI | 1.03 | InChI=1S/C11H11N2O4PS/c12-11-13-10-8-5-7(17-18(14,15)16)3-1-6(8)2-4-9(10)19-11/h1,3,5H,2,4H2,(H2,12,13)(H2,14,15,16) |
| InChIKey | InChI | 1.03 | SJPRRARYUZBNAD-UHFFFAOYSA-N |
