H29
Summary
Name: | 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine |
Formula: | C12 H13 N3 S |
Formal charge: | 0 |
Formula weight: | 231.317 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 6-(6,7-dihydro-4~{H}-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H13N3S/c13-10-1-2-12(14-7-10)15-5-3-11-9(8-15)4-6-16-11/h1-2,4,6-7H,3,5,8,13H2 |
InChIKey | InChI | 1.03 | VEJCYGREDNZFMG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc(nc1)N2CCc3sccc3C2 |
SMILES | CACTVS | 3.385 | Nc1ccc(nc1)N2CCc3sccc3C2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1N)N2CCc3c(ccs3)C2 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1N)N2CCc3c(ccs3)C2 |