4-[(3,4-dichlorophenyl)carbamothioylamino]benzoate

Systemtic Name: 4-[(3,4-dichlorophenyl)carbamothioylamino]benzoate Openeye Name: 4-[(3,4-dichlorophenyl)carbamothioylamino]benzoate CAS Name: 4-[[(3,4-dichloroanilino)-sulfanylidenemethyl]amino]benzoate IUPAC Name: 4-[(3,4-dichlorophenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,4-dichlorophenyl)thiocarbamoylamino]benzoate Formula: C14H9Cl2N2O2S- MolecularWeight: 340.20446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])NC(=S)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])NC(=S)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H10Cl2N2O2S/c15-11-6-5-10(7-12(11)16)18-14(21)17-9-3-1-8(2-4-9)13(19)20/h1-7H,(H,19,20)(H2,17,18,21)/p-1