[2-oxidanylidene-2-(thiophen-2-ylcarbonyldiazenyl)ethyl] 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonyldiazenyl)ethyl] 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylazo)ethyl] 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-oxo-2-[oxo(thiophen-2-yl)methyl]azoethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonyldiazenyl)ethyl] 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-keto-2-(2-thenoylazo)ethyl] ester Formula: C21H13N3O4S2 MolecularWeight: 435.47562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC(=O)N=NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC(=O)N=NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H13N3O4S2/c22-12-14-6-1-3-8-16(14)30-17-9-4-2-7-15(17)21(27)28-13-19(25)23-24-20(26)18-10-5-11-29-18/h1-11H,13H2