ethyl 3-methyl-4-methylsulfanyl-5-phenyldiazenyl-benzoate

Systemtic Name: ethyl 3-methyl-4-methylsulfanyl-5-phenyldiazenyl-benzoate Openeye Name: ethyl 3-methyl-4-methylsulfanyl-5-phenylazo-benzoate CAS Name: 3-methyl-4-(methylthio)-5-phenyldiazenylbenzoic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-methylsulfanyl-5-phenyldiazenylbenzoate Traditional Name: 3-methyl-4-(methylthio)-5-phenylazo-benzoic acid ethyl ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)N=NC2=CC=CC=C2)SC)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)N=NC2=CC=CC=C2)SC)C

InChI

InChI=1S/C17H18N2O2S/c1-4-21-17(20)13-10-12(2)16(22-3)15(11-13)19-18-14-8-6-5-7-9-14/h5-11H,4H2,1-3H3