W1S
Summary
Name: | (8S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxamide |
Formula: | C8 H11 N3 O |
Formal charge: | 0 |
Formula weight: | 165.192 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (8S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxamide |
OpenEye OEToolkits | 2.0.7 | (8~{S})-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n21CCCC(c1ncc2)C(=O)N |
InChI | InChI | 1.03 | InChI=1S/C8H11N3O/c9-7(12)6-2-1-4-11-5-3-10-8(6)11/h3,5-6H,1-2,4H2,(H2,9,12)/t6-/m1/s1 |
InChIKey | InChI | 1.03 | VSXNZKCCQSDVAD-ZCFIWIBFSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)[C@H]1CCCn2ccnc12 |
SMILES | CACTVS | 3.385 | NC(=O)[CH]1CCCn2ccnc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cn2c(n1)[C@H](CCC2)C(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cn2c(n1)C(CCC2)C(=O)N |