methyl 4-(phenylazanylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(phenylazanylcarbamothioylamino)benzoate Openeye Name: methyl 4-(anilinocarbamothioylamino)benzoate CAS Name: 4-[[(phenylhydrazo)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(anilinocarbamothioylamino)benzoate Traditional Name: 4-(anilinothiocarbamoylamino)benzoic acid methyl ester Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NNC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NNC2=CC=CC=C2

InChI

InChI=1S/C15H15N3O2S/c1-20-14(19)11-7-9-12(10-8-11)16-15(21)18-17-13-5-3-2-4-6-13/h2-10,17H,1H3,(H2,16,18,21)