9EX
Summary
Name: | (2S)-2-methyl-3-sulfanyl-propan-1-ol |
Formula: | C4 H10 O S |
Formal charge: | 0 |
Formula weight: | 106.187 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | (2~{S})-2-methyl-3-sulfanyl-propan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C4H10OS/c1-4(2-5)3-6/h4-6H,2-3H2,1H3/t4-/m0/s1 |
InChIKey | InChI | 1.03 | FCIVYWQHILCTLI-BYPYZUCNSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](CO)CS |
SMILES | CACTVS | 3.385 | C[CH](CO)CS |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C[C@@H](CO)CS |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(CO)CS |