3,5-bis[(2-cyanophenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3,5-bis[(2-cyanophenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile Openeye Name: 3,5-bis[(2-cyanophenyl)methylsulfanyl]isothiazole-4-carbonitrile CAS Name: 3,5-bis[(2-cyanophenyl)methylthio]-4-isothiazolecarbonitrile IUPAC Name: 3,5-bis[(2-cyanophenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile Traditional Name: 3,5-bis[(2-cyanobenzyl)thio]isothiazole-4-carbonitrile Formula: C20H12N4S3 MolecularWeight: 404.53108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=C(C(=NS2)SCC3=CC=CC=C3C#N)C#N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=C(C(=NS2)SCC3=CC=CC=C3C#N)C#N)C#N

InChI

InChI=1S/C20H12N4S3/c21-9-14-5-1-3-7-16(14)12-25-19-18(11-23)20(27-24-19)26-13-17-8-4-2-6-15(17)10-22/h1-8H,12-13H2