S-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] ethanethioate Openeye Name: S-[2-oxo-2-(4-phenylazoanilino)ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: S-[2-oxo-2-(4-phenyldiazenylanilino)ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2

Isomeric SMILES

CC(=O)SCC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2

InChI

InChI=1S/C16H15N3O2S/c1-12(20)22-11-16(21)17-13-7-9-15(10-8-13)19-18-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,17,21)