3MH
Summary
Name: | 1-hydroxy-3-methylpyridine-2(1H)-thione |
Formula: | C6 H7 N O S |
Formal charge: | 0 |
Formula weight: | 141.191 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1-hydroxy-3-methylpyridine-2(1H)-thione |
OpenEye OEToolkits | 1.7.6 | 3-methyl-1-oxidanyl-pyridine-2-thione |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | S=C1C(=CC=CN1O)C |
InChI | InChI | 1.03 | InChI=1S/C6H7NOS/c1-5-3-2-4-7(8)6(5)9/h2-4,8H,1H3 |
InChIKey | InChI | 1.03 | YFGDWYKLGMSVNE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC1=CC=CN(O)C1=S |
SMILES | CACTVS | 3.385 | CC1=CC=CN(O)C1=S |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC1=CC=CN(C1=S)O |
SMILES | OpenEye OEToolkits | 1.7.6 | CC1=CC=CN(C1=S)O |