ethyl 3-(azanylcarbamothioylamino)-4-chloranyl-benzoate

Systemtic Name: ethyl 3-(azanylcarbamothioylamino)-4-chloranyl-benzoate Openeye Name: ethyl 3-(aminocarbamothioylamino)-4-chloro-benzoate CAS Name: 4-chloro-3-[[hydrazinyl(sulfanylidene)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(aminocarbamothioylamino)-4-chlorobenzoate Traditional Name: 3-(aminothiocarbamoylamino)-4-chloro-benzoic acid ethyl ester Formula: C10H12ClN3O2S MolecularWeight: 273.73918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)Cl)NC(=S)NN

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)Cl)NC(=S)NN

InChI

InChI=1S/C10H12ClN3O2S/c1-2-16-9(15)6-3-4-7(11)8(5-6)13-10(17)14-12/h3-5H,2,12H2,1H3,(H2,13,14,17)