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Summary
| Name: | TRIMETHOPRIM |
| Formula: | C14 H18 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 290.318 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5-(3,4,5-trimethoxybenzyl)pyrimidine-2,4-diamine |
| OpenEye OEToolkits | 1.5.0 | 5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c(N)c(cnc1N)Cc2cc(OC)c(OC)c(OC)c2 |
| SMILES_CANONICAL | CACTVS | 3.341 | COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |
| SMILES | CACTVS | 3.341 | COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1cc(cc(c1OC)OC)Cc2cnc(nc2N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | COc1cc(cc(c1OC)OC)Cc2cnc(nc2N)N |
| InChI | InChI | 1.03 | InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18) |
| InChIKey | InChI | 1.03 | IEDVJHCEMCRBQM-UHFFFAOYSA-N |
