methyl 3-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-oxo-2-(4-phenylazoanilino)ethyl]sulfanylpropanoate CAS Name: 3-[[2-oxo-2-(4-phenyldiazenylanilino)ethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-oxo-2-(4-phenyldiazenylanilino)ethyl]sulfanylpropanoate Traditional Name: 3-[[2-keto-2-(4-phenylazoanilino)ethyl]thio]propionic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCSCC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2

InChI

InChI=1S/C18H19N3O3S/c1-24-18(23)11-12-25-13-17(22)19-14-7-9-16(10-8-14)21-20-15-5-3-2-4-6-15/h2-10H,11-13H2,1H3,(H,19,22)