methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate

Systemtic Name: methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate Openeye Name: methyl 2-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioylamino]benzoate CAS Name: 2-[[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate Traditional Name: 2-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoylamino]benzoic acid methyl ester Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=S)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=S)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C16H14N2O3S2/c1-21-15(20)12-6-2-3-7-13(12)17-16(22)18-14(19)9-8-11-5-4-10-23-11/h2-10H,1H3,(H2,17,18,19,22)/b9-8+