ethyl 4-[1-(oxolan-2-yl)ethylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[1-(oxolan-2-yl)ethylcarbamothioylamino]benzoate Openeye Name: ethyl 4-(1-tetrahydrofuran-2-ylethylcarbamothioylamino)benzoate CAS Name: 4-[[[1-(2-oxolanyl)ethylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-(oxolan-2-yl)ethylcarbamothioylamino]benzoate Traditional Name: 4-[1-(tetrahydrofuryl)ethylthiocarbamoylamino]benzoic acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)C2CCCO2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)C2CCCO2

InChI

InChI=1S/C16H22N2O3S/c1-3-20-15(19)12-6-8-13(9-7-12)18-16(22)17-11(2)14-5-4-10-21-14/h6-9,11,14H,3-5,10H2,1-2H3,(H2,17,18,22)