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

Systemtic Name: 3-methylsulfanyl-5-[4-[2-(4-nitrophenoxy)ethoxy]phenyl]-1,2-thiazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-5-[4-[2-(4-nitrophenoxy)ethoxy]phenyl]isothiazole-4-carbonitrile CAS Name: 3-(methylthio)-5-[4-[2-(4-nitrophenoxy)ethoxy]phenyl]-4-isothiazolecarbonitrile IUPAC Name: 3-methylsulfanyl-5-[4-[2-(4-nitrophenoxy)ethoxy]phenyl]-1,2-thiazole-4-carbonitrile Traditional Name: 3-(methylthio)-5-[4-[2-(4-nitrophenoxy)ethoxy]phenyl]isothiazole-4-carbonitrile Formula: C19H15N3O4S2 MolecularWeight: 413.4701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=C1C#N)C2=CC=C(C=C2)OCCOC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=NSC(=C1C#N)C2=CC=C(C=C2)OCCOC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O4S2/c1-27-19-17(12-20)18(28-21-19)13-2-6-15(7-3-13)25-10-11-26-16-8-4-14(5-9-16)22(23)24/h2-9H,10-11H2,1H3