I0D
Summary
| Name: | 4-chloranyl-2-methyl-5-[(2-methyl-3,4-dihydro-1~{H}-isoquinolin-5-yl)amino]pyridazin-3-one |
| Formula: | C15 H17 Cl N4 O |
| Formal charge: | 0 |
| Formula weight: | 304.775 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-chloranyl-2-methyl-5-[(2-methyl-3,4-dihydro-1~{H}-isoquinolin-5-yl)amino]pyridazin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H17ClN4O/c1-19-7-6-11-10(9-19)4-3-5-12(11)18-13-8-17-20(2)15(21)14(13)16/h3-5,8,18H,6-7,9H2,1-2H3 |
| InChIKey | InChI | 1.03 | YJJYUKCKKSVTAG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1CCc2c(C1)cccc2NC3=C(Cl)C(=O)N(C)N=C3 |
| SMILES | CACTVS | 3.385 | CN1CCc2c(C1)cccc2NC3=C(Cl)C(=O)N(C)N=C3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CN1CCc2c(cccc2NC3=C(C(=O)N(N=C3)C)Cl)C1 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CN1CCc2c(cccc2NC3=C(C(=O)N(N=C3)C)Cl)C1 |
