methyl 2-chloranyl-4-[(4-fluorophenyl)carbonylcarbamothioylamino]-5-methoxy-benzoate

Systemtic Name: methyl 2-chloranyl-4-[(4-fluorophenyl)carbonylcarbamothioylamino]-5-methoxy-benzoate Openeye Name: methyl 2-chloro-4-[(4-fluorobenzoyl)carbamothioylamino]-5-methoxy-benzoate CAS Name: 2-chloro-4-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-[(4-fluorobenzoyl)carbamothioylamino]-5-methoxybenzoate Traditional Name: 2-chloro-4-[(4-fluorobenzoyl)thiocarbamoylamino]-5-methoxy-benzoic acid methyl ester Formula: C17H14ClFN2O4S MolecularWeight: 396.820463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)Cl)NC(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)Cl)NC(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H14ClFN2O4S/c1-24-14-7-11(16(23)25-2)12(18)8-13(14)20-17(26)21-15(22)9-3-5-10(19)6-4-9/h3-8H,1-2H3,(H2,20,21,22,26)