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

Systemtic Name: 5-[4-[3-(4-cyanophenoxy)propoxy]phenyl]-3-methylsulfanyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-[4-[3-(4-cyanophenoxy)propoxy]phenyl]-3-methylsulfanyl-isothiazole-4-carbonitrile CAS Name: 5-[4-[3-(4-cyanophenoxy)propoxy]phenyl]-3-(methylthio)-4-isothiazolecarbonitrile IUPAC Name: 5-[4-[3-(4-cyanophenoxy)propoxy]phenyl]-3-methylsulfanyl-1,2-thiazole-4-carbonitrile Traditional Name: 5-[4-[3-(4-cyanophenoxy)propoxy]phenyl]-3-(methylthio)isothiazole-4-carbonitrile Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=C1C#N)C2=CC=C(C=C2)OCCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

CSC1=NSC(=C1C#N)C2=CC=C(C=C2)OCCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H17N3O2S2/c1-27-21-19(14-23)20(28-24-21)16-5-9-18(10-6-16)26-12-2-11-25-17-7-3-15(13-22)4-8-17/h3-10H,2,11-12H2,1H3