4-[(2-sulfanylidene-1,3-benzothiazol-3-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 4-[(2-sulfanylidene-1,3-benzothiazol-3-yl)carbonyl]benzenecarbonitrile Openeye Name: 4-(2-thioxo-1,3-benzothiazole-3-carbonyl)benzonitrile CAS Name: 4-[oxo-(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]benzonitrile IUPAC Name: 4-(2-sulfanylidene-1,3-benzothiazole-3-carbonyl)benzonitrile Traditional Name: 4-(2-thioxo-1,3-benzothiazole-3-carbonyl)benzonitrile Formula: C15H8N2OS2 MolecularWeight: 296.36682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H8N2OS2/c16-9-10-5-7-11(8-6-10)14(18)17-12-3-1-2-4-13(12)20-15(17)19/h1-8H