N-[3-chloranyl-4-[(5-chloranyl-2-methoxy-4-methyl-phenyl)carbamothioylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[3-chloranyl-4-[(5-chloranyl-2-methoxy-4-methyl-phenyl)carbamothioylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[3-chloro-4-[(5-chloro-2-methoxy-4-methyl-phenyl)carbamothioylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[3-chloro-4-[[(5-chloro-2-methoxy-4-methylanilino)-sulfanylidenemethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[3-chloro-4-[(5-chloro-2-methoxy-4-methylphenyl)carbamothioylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[3-chloro-4-[(5-chloro-2-methoxy-4-methyl-phenyl)thiocarbamoylamino]phenyl]-2-fluoro-benzamide Formula: C22H18Cl2FN3O2S MolecularWeight: 478.366623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)NC(=S)NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)NC(=S)NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl)OC

InChI

InChI=1S/C22H18Cl2FN3O2S/c1-12-9-20(30-2)19(11-15(12)23)28-22(31)27-18-8-7-13(10-16(18)24)26-21(29)14-5-3-4-6-17(14)25/h3-11H,1-2H3,(H,26,29)(H2,27,28,31)