1CY
Summary
| Name: | 1-(4-chlorophenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine |
| Synonyms: | Cycloguanil |
| Formula: | C11 H14 Cl N5 |
| Formal charge: | 0 |
| Formula weight: | 251.715 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | 1-(4-chlorophenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine |
| OpenEye OEToolkits | 1.6.1 | 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | Clc1ccc(cc1)N2C(=NC(=NC2(C)C)N)N |
| SMILES_CANONICAL | CACTVS | 3.352 | CC1(C)N=C(N)N=C(N)N1c2ccc(Cl)cc2 |
| SMILES | CACTVS | 3.352 | CC1(C)N=C(N)N=C(N)N1c2ccc(Cl)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC1(N=C(N=C(N1c2ccc(cc2)Cl)N)N)C |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC1(N=C(N=C(N1c2ccc(cc2)Cl)N)N)C |
| InChI | InChI | 1.03 | InChI=1S/C11H14ClN5/c1-11(2)16-9(13)15-10(14)17(11)8-5-3-7(12)4-6-8/h3-6H,1-2H3,(H4,13,14,15,16) |
| InChIKey | InChI | 1.03 | QMNFFXRFOJIOKZ-UHFFFAOYSA-N |
