ethyl 2-(2-phenylsulfanylethanoylcarbamothioylamino)-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-phenylsulfanylethanoylcarbamothioylamino)-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-phenylsulfanylacetyl)carbamothioylamino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[[[1-oxo-2-(phenylthio)ethyl]amino]-sulfanylidenemethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-phenylsulfanylacetyl)carbamothioylamino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-[[2-(phenylthio)acetyl]thiocarbamoylamino]-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H18N2O3S4 MolecularWeight: 462.62852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=S)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=S)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O3S4/c1-2-25-19(24)17-14(15-9-6-10-27-15)11-29-18(17)22-20(26)21-16(23)12-28-13-7-4-3-5-8-13/h3-11H,2,12H2,1H3,(H2,21,22,23,26)