N5V
Summary
Name: | N-ethyl-N'-1,3-thiazol-2-ylurea |
Formula: | C6 H9 N3 O S |
Formal charge: | 0 |
Formula weight: | 171.22 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-ethyl-N'-1,3-thiazol-2-ylurea |
OpenEye OEToolkits | 2.0.6 | 1-ethyl-3-(1,3-thiazol-2-yl)urea |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N(C(NCC)=O)c1nccs1 |
InChI | InChI | 1.03 | InChI=1S/C6H9N3OS/c1-2-7-5(10)9-6-8-3-4-11-6/h3-4H,2H2,1H3,(H2,7,8,9,10) |
InChIKey | InChI | 1.03 | QJLXNWDDALWJDF-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCNC(=O)Nc1sccn1 |
SMILES | CACTVS | 3.385 | CCNC(=O)Nc1sccn1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCNC(=O)Nc1nccs1 |
SMILES | OpenEye OEToolkits | 2.0.6 | CCNC(=O)Nc1nccs1 |