2-[[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-ethenyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-ethenyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-vinyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[2-(1,3-benzothiazol-2-ylthio)-2-cyanoethenyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyanoethenyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[2-(1,3-benzothiazol-2-ylthio)-2-cyano-vinyl]phenoxy]methyl]benzonitrile Formula: C24H15N3OS2 MolecularWeight: 425.5254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C(C#N)SC3=NC4=CC=CC=C4S3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C(C#N)SC3=NC4=CC=CC=C4S3)C#N

InChI

InChI=1S/C24H15N3OS2/c25-14-18-5-1-2-6-19(18)16-28-20-11-9-17(10-12-20)13-21(15-26)29-24-27-22-7-3-4-8-23(22)30-24/h1-13H,16H2