ZSG
Summary
| Name: | (8S)-5-(2-aminopyrimidin-4-yl)-N-[2-(dimethylamino)ethyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide |
| Formula: | C15 H22 N8 O |
| Formal charge: | 0 |
| Formula weight: | 330.388 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (8S)-5-(2-aminopyrimidin-4-yl)-N-[2-(dimethylamino)ethyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide |
| OpenEye OEToolkits | 2.0.7 | 5-(2-azanylpyrimidin-4-yl)-~{N}-[2-(dimethylamino)ethyl]-6,7-dihydro-4~{H}-pyrazolo[1,5-a]pyrazine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CN(C)CCNC(=O)c1cc2CN(CCn2n1)c1ccnc(N)n1 |
| InChI | InChI | 1.03 | InChI=1S/C15H22N8O/c1-21(2)6-5-17-14(24)12-9-11-10-22(7-8-23(11)20-12)13-3-4-18-15(16)19-13/h3-4,9H,5-8,10H2,1-2H3,(H,17,24)(H2,16,18,19) |
| InChIKey | InChI | 1.03 | SOQWCHRGAQNWSN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCNC(=O)c1cc2CN(CCn2n1)c3ccnc(N)n3 |
| SMILES | CACTVS | 3.385 | CN(C)CCNC(=O)c1cc2CN(CCn2n1)c3ccnc(N)n3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)CCNC(=O)c1cc2n(n1)CCN(C2)c3ccnc(n3)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)CCNC(=O)c1cc2n(n1)CCN(C2)c3ccnc(n3)N |
