2-(3H-1,3-benzothiazol-2-ylidene)-3-[3,5-bis(chloranyl)phenyl]-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[3,5-bis(chloranyl)phenyl]-3-oxidanylidene-propanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3,5-dichlorophenyl)-3-oxo-propanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3,5-dichlorophenyl)-3-oxopropanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3,5-dichlorophenyl)-3-oxopropanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3,5-dichlorophenyl)-3-keto-propionitrile Formula: C16H8Cl2N2OS MolecularWeight: 347.21852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC(=CC(=C3)Cl)Cl)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC(=CC(=C3)Cl)Cl)S2

InChI

InChI=1S/C16H8Cl2N2OS/c17-10-5-9(6-11(18)7-10)15(21)12(8-19)16-20-13-3-1-2-4-14(13)22-16/h1-7,20H