MVZ
Summary
| Name: | 5-bromanyl-3-chloranyl-~{N}-(1~{H}-imidazol-2-yl)-7-methyl-1~{H}-indol-4-amine |
| Formula: | C12 H10 Br Cl N4 |
| Formal charge: | 0 |
| Formula weight: | 325.592 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-bromanyl-3-chloranyl-~{N}-(1~{H}-imidazol-2-yl)-7-methyl-1~{H}-indol-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H10BrClN4/c1-6-4-7(13)11(18-12-15-2-3-16-12)9-8(14)5-17-10(6)9/h2-5,17H,1H3,(H2,15,16,18) |
| InChIKey | InChI | 1.03 | NKEWJSANHAKFDR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(Br)c(Nc2[nH]ccn2)c3c(Cl)c[nH]c13 |
| SMILES | CACTVS | 3.385 | Cc1cc(Br)c(Nc2[nH]ccn2)c3c(Cl)c[nH]c13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(c2c1[nH]cc2Cl)Nc3[nH]ccn3)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(c2c1[nH]cc2Cl)Nc3[nH]ccn3)Br |
