3-methylsulfanyl-5-[4-(2-phenoxyethoxy)phenyl]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-5-[4-(2-phenoxyethoxy)phenyl]-1,2-thiazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-5-[4-(2-phenoxyethoxy)phenyl]isothiazole-4-carbonitrile CAS Name: 3-(methylthio)-5-[4-(2-phenoxyethoxy)phenyl]-4-isothiazolecarbonitrile IUPAC Name: 3-methylsulfanyl-5-[4-(2-phenoxyethoxy)phenyl]-1,2-thiazole-4-carbonitrile Traditional Name: 3-(methylthio)-5-[4-(2-phenoxyethoxy)phenyl]isothiazole-4-carbonitrile Formula: C19H16N2O2S2 MolecularWeight: 368.47254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=C1C#N)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CSC1=NSC(=C1C#N)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C19H16N2O2S2/c1-24-19-17(13-20)18(25-21-19)14-7-9-16(10-8-14)23-12-11-22-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3