2-methoxyethyl 4-oxidanylidene-4-[[(2-propoxyphenyl)carbonylamino]carbamothioylamino]butanoate

Systemtic Name: 2-methoxyethyl 4-oxidanylidene-4-[[(2-propoxyphenyl)carbonylamino]carbamothioylamino]butanoate Openeye Name: 2-methoxyethyl 4-oxo-4-[[(2-propoxybenzoyl)amino]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]amino]butanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-oxo-4-[[(2-propoxybenzoyl)amino]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[(2-propoxybenzoyl)amino]thiocarbamoylamino]butyric acid 2-methoxyethyl ester Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C18H25N3O6S/c1-3-10-26-14-7-5-4-6-13(14)17(24)20-21-18(28)19-15(22)8-9-16(23)27-12-11-25-2/h4-7H,3,8-12H2,1-2H3,(H,20,24)(H2,19,21,22,28)