N-[[3,5-bis(bromanyl)-4-(5-cyanopyridin-2-yl)oxy-phenyl]carbamothioyl]-4-chloranyl-benzamide

Systemtic Name: N-[[3,5-bis(bromanyl)-4-(5-cyanopyridin-2-yl)oxy-phenyl]carbamothioyl]-4-chloranyl-benzamide Openeye Name: 4-chloro-N-[[3,5-dibromo-4-[(5-cyano-2-pyridyl)oxy]phenyl]carbamothioyl]benzamide CAS Name: 4-chloro-N-[[3,5-dibromo-4-[(5-cyano-2-pyridinyl)oxy]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[[3,5-dibromo-4-(5-cyanopyridin-2-yl)oxyphenyl]carbamothioyl]benzamide Traditional Name: 4-chloro-N-[[3,5-dibromo-4-[(5-cyano-2-pyridyl)oxy]phenyl]thiocarbamoyl]benzamide Formula: C20H11Br2ClN4O2S MolecularWeight: 566.65294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)OC3=NC=C(C=C3)C#N)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)OC3=NC=C(C=C3)C#N)Br)Cl

InChI

InChI=1S/C20H11Br2ClN4O2S/c21-15-7-14(26-20(30)27-19(28)12-2-4-13(23)5-3-12)8-16(22)18(15)29-17-6-1-11(9-24)10-25-17/h1-8,10H,(H2,26,27,28,30)