methyl 2-(oxolan-2-ylmethylcarbamothioylamino)benzoate

Systemtic Name: methyl 2-(oxolan-2-ylmethylcarbamothioylamino)benzoate Openeye Name: methyl 2-(tetrahydrofuran-2-ylmethylcarbamothioylamino)benzoate CAS Name: 2-[[(2-oxolanylmethylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-(oxolan-2-ylmethylcarbamothioylamino)benzoate Traditional Name: 2-(tetrahydrofurfurylthiocarbamoylamino)benzoic acid methyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=S)NCC2CCCO2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=S)NCC2CCCO2

InChI

InChI=1S/C14H18N2O3S/c1-18-13(17)11-6-2-3-7-12(11)16-14(20)15-9-10-5-4-8-19-10/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,15,16,20)