ethyl 4-[[(7-chloranylquinolin-4-yl)amino]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[(7-chloranylquinolin-4-yl)amino]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[(7-chloro-4-quinolyl)amino]carbamothioylamino]benzoate CAS Name: 4-[[[(7-chloro-4-quinolinyl)hydrazo]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(7-chloroquinolin-4-yl)amino]carbamothioylamino]benzoate Traditional Name: 4-[[(7-chloro-4-quinolyl)amino]thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H17ClN4O2S MolecularWeight: 400.88188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC2=C3C=CC(=CC3=NC=C2)Cl

InChI

InChI=1S/C19H17ClN4O2S/c1-2-26-18(25)12-3-6-14(7-4-12)22-19(27)24-23-16-9-10-21-17-11-13(20)5-8-15(16)17/h3-11H,2H2,1H3,(H,21,23)(H2,22,24,27)