dimethyl 2-(2-naphthalen-2-ylsulfanylethanoylamino)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-(2-naphthalen-2-ylsulfanylethanoylamino)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(2-naphthylsulfanyl)acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(2-naphthalenylthio)-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-naphthalen-2-ylsulfanylacetyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(2-naphthylthio)acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H19NO5S MolecularWeight: 409.45496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H19NO5S/c1-27-21(25)16-8-10-18(22(26)28-2)19(12-16)23-20(24)13-29-17-9-7-14-5-3-4-6-15(14)11-17/h3-12H,13H2,1-2H3,(H,23,24)