2-(3H-1,3-benzothiazol-2-ylidene)-3-(5-chloranylthiophen-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(5-chloranylthiophen-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(5-chloro-2-thienyl)-3-oxo-propanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(5-chloro-2-thiophenyl)-3-oxopropanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(5-chlorothiophen-2-yl)-3-oxopropanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(5-chloro-2-thienyl)-3-keto-propionitrile Formula: C14H7ClN2OS2 MolecularWeight: 318.80118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC=C(S3)Cl)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC=C(S3)Cl)S2

InChI

InChI=1S/C14H7ClN2OS2/c15-12-6-5-11(19-12)13(18)8(7-16)14-17-9-3-1-2-4-10(9)20-14/h1-6,17H