5-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-2-[(2-fluorophenyl)carbonylamino]-N-phenyl-benzamide

Systemtic Name: 5-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-2-[(2-fluorophenyl)carbonylamino]-N-phenyl-benzamide Openeye Name: 5-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-2-[(2-fluorobenzoyl)amino]-N-phenyl-benzamide CAS Name: 5-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-2-[[(2-fluorophenyl)-oxomethyl]amino]-N-phenylbenzamide IUPAC Name: 5-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]-2-[(2-fluorobenzoyl)amino]-N-phenylbenzamide Traditional Name: 5-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-2-[(2-fluorobenzoyl)amino]-N-phenyl-benzamide Formula: C29H24ClFN4O4S MolecularWeight: 579.041663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3F)C(=O)NC4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3F)C(=O)NC4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C29H24ClFN4O4S/c1-38-25-16-26(39-2)24(15-21(25)30)35-29(40)33-18-12-13-23(34-27(36)19-10-6-7-11-22(19)31)20(14-18)28(37)32-17-8-4-3-5-9-17/h3-16H,1-2H3,(H,32,37)(H,34,36)(H2,33,35,40)