propyl 4-oxidanylidene-4-[[2-(propylcarbamoyl)phenyl]carbamothioylamino]butanoate

Systemtic Name: propyl 4-oxidanylidene-4-[[2-(propylcarbamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: propyl 4-oxo-4-[[2-(propylcarbamoyl)phenyl]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[[2-[oxo(propylamino)methyl]anilino]-sulfanylidenemethyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-oxo-4-[[2-(propylcarbamoyl)phenyl]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[2-(propylcarbamoyl)phenyl]thiocarbamoylamino]butyric acid propyl ester Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)CCC(=O)OCCC

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)CCC(=O)OCCC

InChI

InChI=1S/C18H25N3O4S/c1-3-11-19-17(24)13-7-5-6-8-14(13)20-18(26)21-15(22)9-10-16(23)25-12-4-2/h5-8H,3-4,9-12H2,1-2H3,(H,19,24)(H2,20,21,22,26)