Compound Summary
Compound Information
FRENTIZOLE
Compound Name: | FRENTIZOLE |
Compound CID: | 33334 |
Synonyms: | FRENTIZOLE |
Iupac Name: | 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-phenylurea |
InChI: | InChI=1S/C15H13N3O2S/c1-20-11-7-8-12-13(9-11)21-15(17-12)18-14(19)16-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19) |
InChIKey: | JHBWYQRKOUBPCA-UHFFFAOYSA-N |
Canonical Smiles: | COC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=CC=C3 |
Isomeric Smiles: | COC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=CC=C3 |
Molecular Weight: | 299.3 |
Molecular Formula: | C15H13N3O2S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
FRENTIZOLE
Molecular Weight: | 299.3 |
Molecular Formula: | C15H13N3O2S |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 21 |
Complexity: | 363 |
Synonyms
FRENTIZOLE
Experimental Data
FRENTIZOLE
Experimental Data Visualization
FRENTIZOLE
Statistics Data
FRENTIZOLE
Statistics Data Visualization
FRENTIZOLE
