2-chloranyl-5-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: 2-chloranyl-5-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: 2-chloro-5-[(3-isopropoxybenzoyl)carbamothioylamino]benzoate CAS Name: 2-chloro-5-[[[[oxo-(3-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 2-chloro-5-[(3-propan-2-yloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 2-chloro-5-[(3-isopropoxybenzoyl)thiocarbamoylamino]benzoate Formula: C18H16ClN2O4S- MolecularWeight: 391.84864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C18H17ClN2O4S/c1-10(2)25-13-5-3-4-11(8-13)16(22)21-18(26)20-12-6-7-15(19)14(9-12)17(23)24/h3-10H,1-2H3,(H,23,24)(H2,20,21,22,26)/p-1