butyl 4-(oxolan-2-ylmethylcarbamothioylamino)benzoate

Systemtic Name: butyl 4-(oxolan-2-ylmethylcarbamothioylamino)benzoate Openeye Name: butyl 4-(tetrahydrofuran-2-ylmethylcarbamothioylamino)benzoate CAS Name: 4-[[(2-oxolanylmethylamino)-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(oxolan-2-ylmethylcarbamothioylamino)benzoate Traditional Name: 4-(tetrahydrofurfurylthiocarbamoylamino)benzoic acid butyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2CCCO2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2CCCO2

InChI

InChI=1S/C17H24N2O3S/c1-2-3-10-22-16(20)13-6-8-14(9-7-13)19-17(23)18-12-15-5-4-11-21-15/h6-9,15H,2-5,10-12H2,1H3,(H2,18,19,23)