ULZ
Summary
| Name: | 4-[4-[2-(5-bromanyl-1~{H}-indol-3-yl)ethyl]pyrimidin-2-yl]morpholine |
| Formula: | C18 H19 Br N4 O |
| Formal charge: | 0 |
| Formula weight: | 387.274 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-[4-[2-(5-bromanyl-1~{H}-indol-3-yl)ethyl]pyrimidin-2-yl]morpholine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H19BrN4O/c19-14-2-4-17-16(11-14)13(12-21-17)1-3-15-5-6-20-18(22-15)23-7-9-24-10-8-23/h2,4-6,11-12,21H,1,3,7-10H2 |
| InChIKey | InChI | 1.03 | LPEIQZYVQYBIQO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Brc1ccc2[nH]cc(CCc3ccnc(n3)N4CCOCC4)c2c1 |
| SMILES | CACTVS | 3.385 | Brc1ccc2[nH]cc(CCc3ccnc(n3)N4CCOCC4)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Br)c(c[nH]2)CCc3ccnc(n3)N4CCOCC4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Br)c(c[nH]2)CCc3ccnc(n3)N4CCOCC4 |
