V5T
Summary
| Name: | 4-(1~{H}-indol-3-yl)pyrimidin-2-amine |
| Formula: | C12 H10 N4 |
| Formal charge: | 0 |
| Formula weight: | 210.235 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-(1~{H}-indol-3-yl)pyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H10N4/c13-12-14-6-5-11(16-12)9-7-15-10-4-2-1-3-8(9)10/h1-7,15H,(H2,13,14,16) |
| InChIKey | InChI | 1.03 | QNMZWFNNJMGJPU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nccc(n1)c2c[nH]c3ccccc23 |
| SMILES | CACTVS | 3.385 | Nc1nccc(n1)c2c[nH]c3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)c3ccnc(n3)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)c3ccnc(n3)N |
