Y0H
Summary
| Name: | 3-(4-chlorophenyl)-1-methyl-1H-pyrazol-5-amine |
| Formula: | C10 H10 Cl N3 |
| Formal charge: | 0 |
| Formula weight: | 207.659 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(4-chlorophenyl)-1-methyl-1H-pyrazol-5-amine |
| OpenEye OEToolkits | 2.0.7 | 5-(4-chlorophenyl)-2-methyl-pyrazol-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cn1nc(cc1N)c1ccc(Cl)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C10H10ClN3/c1-14-10(12)6-9(13-14)7-2-4-8(11)5-3-7/h2-6H,12H2,1H3 |
| InChIKey | InChI | 1.06 | ZSFCXTGPGSAWFT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1nc(cc1N)c2ccc(Cl)cc2 |
| SMILES | CACTVS | 3.385 | Cn1nc(cc1N)c2ccc(Cl)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1c(cc(n1)c2ccc(cc2)Cl)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1c(cc(n1)c2ccc(cc2)Cl)N |
