X5M
Summary
| Name: | (4~{R})-3-[4-(diethylamino)-3-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]phenyl]-4-methyl-4,5-dihydro-1~{H}-pyridazin-6-one |
| Formula: | C15 H21 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 305.352 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (4~{R})-3-[4-(diethylamino)-3-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]phenyl]-4-methyl-4,5-dihydro-1~{H}-pyridazin-6-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H21N4O3/c1-4-18(5-2)12-7-6-11(9-13(12)19(21)22)15-10(3)8-14(20)16-17-15/h6-7,9-10H,4-5,8H2,1-3H3,(H,16,20)(H,21,22)/t10-/m1/s1 |
| InChIKey | InChI | 1.03 | OQEBJJKKKZAUSG-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)c1ccc(cc1[N](O)=O)C2=NNC(=O)C[C@H]2C |
| SMILES | CACTVS | 3.385 | CCN(CC)c1ccc(cc1[N](O)=O)C2=NNC(=O)C[CH]2C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCN(CC)c1ccc(cc1[N](=O)O)C2=NNC(=O)C[C@H]2C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCN(CC)c1ccc(cc1[N](=O)O)C2=NNC(=O)CC2C |
