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

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2-fluorophenyl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2-fluorophenyl)sulfanyl-3-oxo-butanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(2-fluorophenyl)thio]-3-oxobutanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2-fluorophenyl)sulfanyl-3-oxobutanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(2-fluorophenyl)thio]-3-keto-butyronitrile Formula: C17H11FN2OS2 MolecularWeight: 342.410443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=CC=CC=C3F)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(/C#N)\C(=O)CSC3=CC=CC=C3F)/S2

InChI

InChI=1S/C17H11FN2OS2/c18-12-5-1-3-7-15(12)22-10-14(21)11(9-19)17-20-13-6-2-4-8-16(13)23-17/h1-8,20H,10H2/b17-11+