diethyl 2-(naphthalen-1-ylcarbamothioylamino)benzene-1,4-dicarboxylate

Systemtic Name: diethyl 2-(naphthalen-1-ylcarbamothioylamino)benzene-1,4-dicarboxylate Openeye Name: diethyl 2-(1-naphthylcarbamothioylamino)benzene-1,4-dicarboxylate CAS Name: 2-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(naphthalen-1-ylcarbamothioylamino)benzene-1,4-dicarboxylate Traditional Name: 2-(1-naphthylthiocarbamoylamino)benzene-1,4-dicarboxylic acid diethyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NC(=S)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NC(=S)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H22N2O4S/c1-3-28-21(26)16-12-13-18(22(27)29-4-2)20(14-16)25-23(30)24-19-11-7-9-15-8-5-6-10-17(15)19/h5-14H,3-4H2,1-2H3,(H2,24,25,30)