3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-[(E)-2-phenylazanylethenyl]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-[(E)-2-phenylazanylethenyl]-1,2-thiazole-4-carbonitrile Openeye Name: 5-[(E)-2-anilinovinyl]-3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]isothiazole-4-carbonitrile CAS Name: 5-[(E)-2-anilinoethenyl]-3-[(2-chloro-6-fluorophenyl)methylthio]-4-isothiazolecarbonitrile IUPAC Name: 5-[(E)-2-anilinoethenyl]-3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile Traditional Name: 5-[(E)-2-anilinovinyl]-3-[(2-chloro-6-fluoro-benzyl)thio]isothiazole-4-carbonitrile Formula: C19H13ClFN3S2 MolecularWeight: 401.908023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC=CC2=C(C(=NS2)SCC3=C(C=CC=C3Cl)F)C#N

Isomeric SMILES

C1=CC=C(C=C1)N/C=C/C2=C(C(=NS2)SCC3=C(C=CC=C3Cl)F)C#N

InChI

InChI=1S/C19H13ClFN3S2/c20-16-7-4-8-17(21)15(16)12-25-19-14(11-22)18(26-24-19)9-10-23-13-5-2-1-3-6-13/h1-10,23H,12H2/b10-9+