propyl 3-(2-methylpropanoylcarbamothioylamino)benzoate

Systemtic Name: propyl 3-(2-methylpropanoylcarbamothioylamino)benzoate Openeye Name: propyl 3-(2-methylpropanoylcarbamothioylamino)benzoate CAS Name: 3-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-(2-methylpropanoylcarbamothioylamino)benzoate Traditional Name: 3-(isobutyrylthiocarbamoylamino)benzoic acid propyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C(C)C

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C(C)C

InChI

InChI=1S/C15H20N2O3S/c1-4-8-20-14(19)11-6-5-7-12(9-11)16-15(21)17-13(18)10(2)3/h5-7,9-10H,4,8H2,1-3H3,(H2,16,17,18,21)