propyl 4-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NNC(=O)C(C)OC1=CC(=C(C=C1)C)C

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NNC(=O)C(C)OC1=CC(=C(C=C1)C)C

InChI

InChI=1S/C19H27N3O5S/c1-5-10-26-17(24)9-8-16(23)20-19(28)22-21-18(25)14(4)27-15-7-6-12(2)13(3)11-15/h6-7,11,14H,5,8-10H2,1-4H3,(H,21,25)(H2,20,22,23,28)