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

Systemtic Name: 3-(cyanomethylsulfanyl)-5-propylsulfanyl-1,2-thiazole-4-carbonitrile Openeye Name: 3-(cyanomethylsulfanyl)-5-propylsulfanyl-isothiazole-4-carbonitrile CAS Name: 3-(cyanomethylthio)-5-(propylthio)-4-isothiazolecarbonitrile IUPAC Name: 3-(cyanomethylsulfanyl)-5-propylsulfanyl-1,2-thiazole-4-carbonitrile Traditional Name: 3-(cyanomethylthio)-5-(propylthio)isothiazole-4-carbonitrile Formula: C9H9N3S3 MolecularWeight: 255.38286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(=NS1)SCC#N)C#N

Isomeric SMILES

CCCSC1=C(C(=NS1)SCC#N)C#N

InChI

InChI=1S/C9H9N3S3/c1-2-4-14-9-7(6-11)8(12-15-9)13-5-3-10/h2,4-5H2,1H3