4-[(6-chloranylpyridin-3-yl)carbamothioylamino]benzamide

Systemtic Name: 4-[(6-chloranylpyridin-3-yl)carbamothioylamino]benzamide Openeye Name: 4-[(6-chloro-3-pyridyl)carbamothioylamino]benzamide CAS Name: 4-[[[(6-chloro-3-pyridinyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[(6-chloropyridin-3-yl)carbamothioylamino]benzamide Traditional Name: 4-[(6-chloro-3-pyridyl)thiocarbamoylamino]benzamide Formula: C13H11ClN4OS MolecularWeight: 306.77064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N)NC(=S)NC2=CN=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)N)NC(=S)NC2=CN=C(C=C2)Cl

InChI

InChI=1S/C13H11ClN4OS/c14-11-6-5-10(7-16-11)18-13(20)17-9-3-1-8(2-4-9)12(15)19/h1-7H,(H2,15,19)(H2,17,18,20)