methyl 4-oxidanylidene-4-[(3-propoxyphenyl)carbamothioylamino]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[(3-propoxyphenyl)carbamothioylamino]butanoate Openeye Name: methyl 4-oxo-4-[(3-propoxyphenyl)carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[(3-propoxyanilino)-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[(3-propoxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-keto-4-[(3-propoxyphenyl)thiocarbamoylamino]butyric acid methyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC(=O)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC(=O)OC

InChI

InChI=1S/C15H20N2O4S/c1-3-9-21-12-6-4-5-11(10-12)16-15(22)17-13(18)7-8-14(19)20-2/h4-6,10H,3,7-9H2,1-2H3,(H2,16,17,18,22)