B0K
Summary
| Name: | 3-[4,5,6,7-tetrakis(bromanyl)benzimidazol-1-yl]propan-1-amine |
| Formula: | C10 H9 Br4 N3 |
| Formal charge: | 0 |
| Formula weight: | 490.815 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-[4,5,6,7-tetrakis(bromanyl)benzimidazol-1-yl]propan-1-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H9Br4N3/c11-5-6(12)8(14)10-9(7(5)13)16-4-17(10)3-1-2-15/h4H,1-3,15H2 |
| InChIKey | InChI | 1.03 | ZSGVCOITZQLDSD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCCn1cnc2c(Br)c(Br)c(Br)c(Br)c12 |
| SMILES | CACTVS | 3.385 | NCCCn1cnc2c(Br)c(Br)c(Br)c(Br)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1nc2c(n1CCCN)c(c(c(c2Br)Br)Br)Br |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1nc2c(n1CCCN)c(c(c(c2Br)Br)Br)Br |
