Molecule ID: 9796266

IUPAC Name: 3,4-dichloro-N-(2-cyanophenyl)-1,2-thiazole-5-carboxamide

Description: The molecule is a monocarboxylic acid amide resulting from the formal condensation of the carboxy group of 3,4-dichloro-1,2-thiazole-5-carboxylic acid with o-cyanoaniline. It is a fungicide used for the control of rice blast. It has a role as an antifungal agrochemical. It is a monocarboxylic acid amide, a nitrile, an organochlorine compound, an anilide fungicide and a member of 1,2-thiazoles.

SMILES: N#Cc1ccccc1N=C(O)c1snc(Cl)c1Cl

SELFIES: [N][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Branch1][C][O][C][S][N][=C][Branch1][C][Cl][C][=Ring1][=Branch1][Cl]

InChI: InChI=1S/C11H5Cl2N3OS/c12-8-9(18-16-10(8)13)11(17)15-7-4-2-1-3-6(7)5-14/h1-4H,(H,15,17)

Molecular Properties:
- Polar Surface Area: 94.0 Ų
- LogP: 4.0