DCD
Summary
Name: | DIETHYLCARBAMODITHIOIC ACID |
Formula: | C5 H11 N S2 |
Formal charge: | 0 |
Formula weight: | 149.278 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | diethylcarbamodithioic acid |
OpenEye OEToolkits | 1.5.0 | diethylaminomethanedithioic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | S=C(S)N(CC)CC |
SMILES_CANONICAL | CACTVS | 3.341 | CCN(CC)C(S)=S |
SMILES | CACTVS | 3.341 | CCN(CC)C(S)=S |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCN(CC)C(=S)S |
SMILES | OpenEye OEToolkits | 1.5.0 | CCN(CC)C(=S)S |
InChI | InChI | 1.03 | InChI=1S/C5H11NS2/c1-3-6(4-2)5(7)8/h3-4H2,1-2H3,(H,7,8) |
InChIKey | InChI | 1.03 | LMBWSYZSUOEYSN-UHFFFAOYSA-N |