EQX
Summary
Name: | 4-[2-(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)hydrazinyl]-4-oxidanylidene-butanoic acid |
Formula: | C14 H14 N6 O3 |
Formal charge: | 0 |
Formula weight: | 314.299 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-[2-(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)hydrazinyl]-4-oxidanylidene-butanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H14N6O3/c1-8-15-13-9-4-2-3-5-10(9)16-14(20(13)19-8)18-17-11(21)6-7-12(22)23/h2-5H,6-7H2,1H3,(H,16,18)(H,17,21)(H,22,23) |
InChIKey | InChI | 1.03 | JYHOPYYRJYRCCN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1nn2c(NNC(=O)CCC(O)=O)nc3ccccc3c2n1 |
SMILES | CACTVS | 3.385 | Cc1nn2c(NNC(=O)CCC(O)=O)nc3ccccc3c2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1nc2c3ccccc3nc(n2n1)NNC(=O)CCC(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1nc2c3ccccc3nc(n2n1)NNC(=O)CCC(=O)O |