pentyl 4-methylsulfanyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoate

Systemtic Name: pentyl 4-methylsulfanyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoate Openeye Name: pentyl 4-methylsulfanyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoate CAS Name: 4-(methylthio)-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid pentyl ester IUPAC Name: pentyl 4-methylsulfanyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoate Traditional Name: 4-(methylthio)-2-[(3,4,5-trimethoxybenzoyl)amino]butyric acid amyl ester Formula: C20H31NO6S MolecularWeight: 413.52824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCSC)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

CCCCCOC(=O)C(CCSC)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC

InChI

InChI=1S/C20H31NO6S/c1-6-7-8-10-27-20(23)15(9-11-28-5)21-19(22)14-12-16(24-2)18(26-4)17(13-14)25-3/h12-13,15H,6-11H2,1-5H3,(H,21,22)