3-[[5-chloranyl-2-(dimethylamino)phenyl]sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide

Systemtic Name: 3-[[5-chloranyl-2-(dimethylamino)phenyl]sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide Openeye Name: 3-[[5-chloro-2-(dimethylamino)phenyl]sulfanylcarbamoylamino]-2-fluoro-4-phenyl-benzamide CAS Name: 3-[[[[[5-chloro-2-(dimethylamino)phenyl]thio]amino]-oxomethyl]amino]-2-fluoro-4-phenylbenzamide IUPAC Name: 3-[[5-chloro-2-(dimethylamino)phenyl]sulfanylcarbamoylamino]-2-fluoro-4-phenylbenzamide Traditional Name: 3-[[[5-chloro-2-(dimethylamino)phenyl]thio]carbamoylamino]-2-fluoro-4-phenyl-benzamide Formula: C22H20ClFN4O2S MolecularWeight: 458.936203

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)Cl)SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)Cl)SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C22H20ClFN4O2S/c1-28(2)17-11-8-14(23)12-18(17)31-27-22(30)26-20-15(13-6-4-3-5-7-13)9-10-16(19(20)24)21(25)29/h3-12H,1-2H3,(H2,25,29)(H2,26,27,30)