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

Systemtic Name: N-[4-[(5-chloranyl-2-methoxy-4-methyl-phenyl)carbamothioylamino]-2-methyl-phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(5-chloro-2-methoxy-4-methyl-phenyl)carbamothioylamino]-2-methyl-phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[(5-chloro-2-methoxy-4-methylanilino)-sulfanylidenemethyl]amino]-2-methylphenyl]-2-fluorobenzamide IUPAC Name: N-[4-[(5-chloro-2-methoxy-4-methylphenyl)carbamothioylamino]-2-methylphenyl]-2-fluorobenzamide Traditional Name: N-[4-[(5-chloro-2-methoxy-4-methyl-phenyl)thiocarbamoylamino]-2-methyl-phenyl]-2-fluoro-benzamide Formula: C23H21ClFN3O2S MolecularWeight: 457.948143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClFN3O2S/c1-13-11-21(30-3)20(12-17(13)24)28-23(31)26-15-8-9-19(14(2)10-15)27-22(29)16-6-4-5-7-18(16)25/h4-12H,1-3H3,(H,27,29)(H2,26,28,31)