(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-N-(4-chlorophenyl)-2-cyano-ethanethioamide

Systemtic Name: (2E)-2-(3H-1,3-benzoxazol-2-ylidene)-N-(4-chlorophenyl)-2-cyano-ethanethioamide Openeye Name: (2E)-2-(3H-1,3-benzoxazol-2-ylidene)-N-(4-chlorophenyl)-2-cyano-thioacetamide CAS Name: (2E)-2-(3H-1,3-benzoxazol-2-ylidene)-N-(4-chlorophenyl)-2-cyanoethanethioamide IUPAC Name: (2E)-2-(3H-1,3-benzoxazol-2-ylidene)-N-(4-chlorophenyl)-2-cyanoethanethioamide Traditional Name: (2E)-2-(3H-1,3-benzoxazol-2-ylidene)-N-(4-chlorophenyl)-2-cyano-thioacetamide Formula: C16H10ClN3OS MolecularWeight: 327.7881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=S)NC3=CC=C(C=C3)Cl)O2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(/C#N)\C(=S)NC3=CC=C(C=C3)Cl)/O2

InChI

InChI=1S/C16H10ClN3OS/c17-10-5-7-11(8-6-10)19-16(22)12(9-18)15-20-13-3-1-2-4-14(13)21-15/h1-8,20H,(H,19,22)/b15-12+