methyl 4-(benzamidocarbamothioylamino)benzoate

Systemtic Name: methyl 4-(benzamidocarbamothioylamino)benzoate Openeye Name: methyl 4-(benzamidocarbamothioylamino)benzoate CAS Name: 4-[[(benzoylhydrazo)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(benzamidocarbamothioylamino)benzoate Traditional Name: 4-(benzamidothiocarbamoylamino)benzoic acid methyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S/c1-22-15(21)12-7-9-13(10-8-12)17-16(23)19-18-14(20)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,20)(H2,17,19,23)