(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,5-dimethylphenyl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,5-dimethylphenyl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,5-dimethylphenyl)sulfanyl-3-oxo-butanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(2,5-dimethylphenyl)thio]-3-oxobutanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,5-dimethylphenyl)sulfanyl-3-oxobutanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(2,5-dimethylphenyl)thio]-3-keto-butyronitrile Formula: C19H16N2OS2 MolecularWeight: 352.47314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)C(=C2NC3=CC=CC=C3S2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)/C(=C/2\NC3=CC=CC=C3S2)/C#N

InChI

InChI=1S/C19H16N2OS2/c1-12-7-8-13(2)18(9-12)23-11-16(22)14(10-20)19-21-15-5-3-4-6-17(15)24-19/h3-9,21H,11H2,1-2H3/b19-14+