5-(3,4-dichlorophenyl)-3-[(2-fluorophenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile

Systemtic Name: 5-(3,4-dichlorophenyl)-3-[(2-fluorophenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile Openeye Name: 5-(3,4-dichlorophenyl)-3-[(2-fluorophenyl)methylsulfanyl]isoxazole-4-carbonitrile CAS Name: 5-(3,4-dichlorophenyl)-3-[(2-fluorophenyl)methylthio]-4-isoxazolecarbonitrile IUPAC Name: 5-(3,4-dichlorophenyl)-3-[(2-fluorophenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile Traditional Name: 5-(3,4-dichlorophenyl)-3-[(2-fluorobenzyl)thio]isoxazole-4-carbonitrile Formula: C17H9Cl2FN2OS MolecularWeight: 379.235563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NOC(=C2C#N)C3=CC(=C(C=C3)Cl)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NOC(=C2C#N)C3=CC(=C(C=C3)Cl)Cl)F

InChI

InChI=1S/C17H9Cl2FN2OS/c18-13-6-5-10(7-14(13)19)16-12(8-21)17(22-23-16)24-9-11-3-1-2-4-15(11)20/h1-7H,9H2