5-(3-chlorophenyl)-3-methylsulfanyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-(3-chlorophenyl)-3-methylsulfanyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-(3-chlorophenyl)-3-methylsulfanyl-isothiazole-4-carbonitrile CAS Name: 5-(3-chlorophenyl)-3-(methylthio)-4-isothiazolecarbonitrile IUPAC Name: 5-(3-chlorophenyl)-3-methylsulfanyl-1,2-thiazole-4-carbonitrile Traditional Name: 5-(3-chlorophenyl)-3-(methylthio)isothiazole-4-carbonitrile Formula: C11H7ClN2S2 MolecularWeight: 266.76968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=C1C#N)C2=CC(=CC=C2)Cl

Isomeric SMILES

CSC1=NSC(=C1C#N)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C11H7ClN2S2/c1-15-11-9(6-13)10(16-14-11)7-3-2-4-8(12)5-7/h2-5H,1H3