UMT
Summary
| Name: | 4-[4-[2-(1~{H}-indol-3-yl)ethyl]pyrimidin-2-yl]morpholine |
| Formula: | C18 H20 N4 O |
| Formal charge: | 0 |
| Formula weight: | 308.378 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-[4-[2-(1~{H}-indol-3-yl)ethyl]pyrimidin-2-yl]morpholine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H20N4O/c1-2-4-17-16(3-1)14(13-20-17)5-6-15-7-8-19-18(21-15)22-9-11-23-12-10-22/h1-4,7-8,13,20H,5-6,9-12H2 |
| InChIKey | InChI | 1.03 | UEMXDZGQUZIRAH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CN(CCO1)c2nccc(CCc3c[nH]c4ccccc34)n2 |
| SMILES | CACTVS | 3.385 | C1CN(CCO1)c2nccc(CCc3c[nH]c4ccccc34)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)CCc3ccnc(n3)N4CCOCC4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)CCc3ccnc(n3)N4CCOCC4 |
