(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1,3-benzothiazol-2-ylsulfanyl)-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1,3-benzothiazol-2-ylsulfanyl)-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1,3-benzothiazol-2-ylsulfanyl)-3-oxo-pentanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1,3-benzothiazol-2-ylthio)-3-oxopentanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1,3-benzothiazol-2-ylsulfanyl)-3-oxopentanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1,3-benzothiazol-2-ylthio)-3-keto-valeronitrile Formula: C19H13N3OS3 MolecularWeight: 395.52102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(=C1NC2=CC=CC=C2S1)C#N)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)/C(=C/1\NC2=CC=CC=C2S1)/C#N)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H13N3OS3/c1-11(24-19-22-14-7-3-5-9-16(14)26-19)17(23)12(10-20)18-21-13-6-2-4-8-15(13)25-18/h2-9,11,21H,1H3/b18-12+