propyl 4-methylsulfanyl-2-[(3,4,5-triethoxyphenyl)carbonylamino]butanoate

Systemtic Name: propyl 4-methylsulfanyl-2-[(3,4,5-triethoxyphenyl)carbonylamino]butanoate Openeye Name: propyl 4-methylsulfanyl-2-[(3,4,5-triethoxybenzoyl)amino]butanoate CAS Name: 4-(methylthio)-2-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-methylsulfanyl-2-[(3,4,5-triethoxybenzoyl)amino]butanoate Traditional Name: 4-(methylthio)-2-[(3,4,5-triethoxybenzoyl)amino]butyric acid propyl ester Formula: C21H33NO6S MolecularWeight: 427.55482

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CCSC)NC(=O)C1=CC(=C(C(=C1)OCC)OCC)OCC

Isomeric SMILES

CCCOC(=O)C(CCSC)NC(=O)C1=CC(=C(C(=C1)OCC)OCC)OCC

InChI

InChI=1S/C21H33NO6S/c1-6-11-28-21(24)16(10-12-29-5)22-20(23)15-13-17(25-7-2)19(27-9-4)18(14-15)26-8-3/h13-14,16H,6-12H2,1-5H3,(H,22,23)