VE3
Summary
Name: | N,N,4-triethyl-1,2,3-thiadiazole-5-carboxamide |
Formula: | C9 H15 N3 O S |
Formal charge: | 0 |
Formula weight: | 213.3 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N,N,4-triethyl-1,2,3-thiadiazole-5-carboxamide |
OpenEye OEToolkits | 2.0.7 | ~{N},~{N},4-triethyl-1,2,3-thiadiazole-5-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(c1snnc1CC)N(CC)CC |
InChI | InChI | 1.06 | InChI=1S/C9H15N3OS/c1-4-7-8(14-11-10-7)9(13)12(5-2)6-3/h4-6H2,1-3H3 |
InChIKey | InChI | 1.06 | ACXPFDFOYMLQNM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)C(=O)c1snnc1CC |
SMILES | CACTVS | 3.385 | CCN(CC)C(=O)c1snnc1CC |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1c(snn1)C(=O)N(CC)CC |
SMILES | OpenEye OEToolkits | 2.0.7 | CCc1c(snn1)C(=O)N(CC)CC |