dimethyl 5-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C24H20N2O5S MolecularWeight: 448.491

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C24H20N2O5S/c1-30-22(28)17-12-18(23(29)31-2)14-19(13-17)25-24(32)26-21(27)11-10-16-8-5-7-15-6-3-4-9-20(15)16/h3-14H,1-2H3,(H2,25,26,27,32)/b11-10+