N-(5-chloranylpyridin-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(5-chloro-2-pyridinyl)acetamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C20H17ClN4OS2 MolecularWeight: 428.95818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCC(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SCC(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C20H17ClN4OS2/c21-14-6-11-18(22-12-14)25-19(26)13-28-17-9-7-16(8-10-17)24-20(27)23-15-4-2-1-3-5-15/h1-12H,13H2,(H,22,25,26)(H2,23,24,27)