5-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-3-oxidanylidene-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-3-oxidanylidene-1,2-thiazole-4-carbonitrile Openeye Name: 5-[4-chloro-3-(trifluoromethyl)anilino]-3-oxo-isothiazole-4-carbonitrile CAS Name: 5-[4-chloro-3-(trifluoromethyl)anilino]-3-oxo-4-isothiazolecarbonitrile IUPAC Name: 5-[4-chloro-3-(trifluoromethyl)anilino]-3-oxo-1,2-thiazole-4-carbonitrile Traditional Name: 5-[4-chloro-3-(trifluoromethyl)anilino]-3-keto-4-isothiazoline-4-carbonitrile Formula: C11H5ClF3N3OS MolecularWeight: 319.69011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C(=O)NS2)C#N)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C(=O)NS2)C#N)C(F)(F)F)Cl

InChI

InChI=1S/C11H5ClF3N3OS/c12-8-2-1-5(3-7(8)11(13,14)15)17-10-6(4-16)9(19)18-20-10/h1-3,17H,(H,18,19)