ethyl 3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]benzoate Openeye Name: ethyl 3-[[(E)-3-(2-furyl)prop-2-enoyl]carbamothioylamino]benzoate CAS Name: 3-[[[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]benzoate Traditional Name: 3-[[(E)-3-(2-furyl)acryloyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=CO2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=CO2

InChI

InChI=1S/C17H16N2O4S/c1-2-22-16(21)12-5-3-6-13(11-12)18-17(24)19-15(20)9-8-14-7-4-10-23-14/h3-11H,2H2,1H3,(H2,18,19,20,24)/b9-8+