4-methoxy-3-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: 4-methoxy-3-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: 3-[(3-isopropoxybenzoyl)carbamothioylamino]-4-methoxy-benzoate CAS Name: 4-methoxy-3-[[[[oxo-(3-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 4-methoxy-3-[(3-propan-2-yloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 3-[(3-isopropoxybenzoyl)thiocarbamoylamino]-4-methoxy-benzoate Formula: C19H19N2O5S- MolecularWeight: 387.42956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5S/c1-11(2)26-14-6-4-5-12(9-14)17(22)21-19(27)20-15-10-13(18(23)24)7-8-16(15)25-3/h4-11H,1-3H3,(H,23,24)(H2,20,21,22,27)/p-1