3-(cyanomethylsulfanyl)-5-(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-(cyanomethylsulfanyl)-5-(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile Openeye Name: 5-benzylsulfanyl-3-(cyanomethylsulfanyl)isothiazole-4-carbonitrile CAS Name: 3-(cyanomethylthio)-5-(phenylmethylthio)-4-isothiazolecarbonitrile IUPAC Name: 5-benzylsulfanyl-3-(cyanomethylsulfanyl)-1,2-thiazole-4-carbonitrile Traditional Name: 5-(benzylthio)-3-(cyanomethylthio)isothiazole-4-carbonitrile Formula: C13H9N3S3 MolecularWeight: 303.42566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=NS2)SCC#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=NS2)SCC#N)C#N

InChI

InChI=1S/C13H9N3S3/c14-6-7-17-12-11(8-15)13(19-16-12)18-9-10-4-2-1-3-5-10/h1-5H,7,9H2