dimethyl 5-(2-tert-butylsulfanylethanoylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(2-tert-butylsulfanylethanoylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-tert-butylsulfanylacetyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(tert-butylthio)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-tert-butylsulfanylacetyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(tert-butylthio)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)SCC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H21NO5S/c1-16(2,3)23-9-13(18)17-12-7-10(14(19)21-4)6-11(8-12)15(20)22-5/h6-8H,9H2,1-5H3,(H,17,18)