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

Systemtic Name: 3,5-bis(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile Openeye Name: 3,5-bis(benzylsulfanyl)isothiazole-4-carbonitrile CAS Name: 3,5-bis(phenylmethylthio)-4-isothiazolecarbonitrile IUPAC Name: 3,5-bis(benzylsulfanyl)-1,2-thiazole-4-carbonitrile Traditional Name: 3,5-bis(benzylthio)isothiazole-4-carbonitrile Formula: C18H14N2S3 MolecularWeight: 354.51216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=NS2)SCC3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=NS2)SCC3=CC=CC=C3)C#N

InChI

InChI=1S/C18H14N2S3/c19-11-16-17(21-12-14-7-3-1-4-8-14)20-23-18(16)22-13-15-9-5-2-6-10-15/h1-10H,12-13H2