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

Systemtic Name: methyl 4-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 4-[(3-isopropoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-(3-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-propan-2-yloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(3-isopropoxybenzoyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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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)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-12(2)25-16-6-4-5-14(11-16)17(22)21-19(26)20-15-9-7-13(8-10-15)18(23)24-3/h4-12H,1-3H3,(H2,20,21,22,26)