propyl 4-[(4-oxidanylidene-4-propoxy-butanoyl)carbamothioylamino]benzoate

Systemtic Name: propyl 4-[(4-oxidanylidene-4-propoxy-butanoyl)carbamothioylamino]benzoate Openeye Name: propyl 4-[(4-oxo-4-propoxy-butanoyl)carbamothioylamino]benzoate CAS Name: 4-[[[(1,4-dioxo-4-propoxybutyl)amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(4-oxo-4-propoxybutanoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-keto-4-propoxy-butanoyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OCCC

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OCCC

InChI

InChI=1S/C18H24N2O5S/c1-3-11-24-16(22)10-9-15(21)20-18(26)19-14-7-5-13(6-8-14)17(23)25-12-4-2/h5-8H,3-4,9-12H2,1-2H3,(H2,19,20,21,26)