ethyl 4-[[furan-2-ylmethyl(thiophen-2-ylmethyl)carbamothioyl]amino]benzoate

Systemtic Name: ethyl 4-[[furan-2-ylmethyl(thiophen-2-ylmethyl)carbamothioyl]amino]benzoate Openeye Name: ethyl 4-[[2-furylmethyl(2-thienylmethyl)carbamothioyl]amino]benzoate CAS Name: 4-[[[2-furanylmethyl(thiophen-2-ylmethyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[furan-2-ylmethyl(thiophen-2-ylmethyl)carbamothioyl]amino]benzoate Traditional Name: 4-[[2-furfuryl(2-thenyl)thiocarbamoyl]amino]benzoic acid ethyl ester Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)N(CC2=CC=CO2)CC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N(CC2=CC=CO2)CC3=CC=CS3

InChI

InChI=1S/C20H20N2O3S2/c1-2-24-19(23)15-7-9-16(10-8-15)21-20(26)22(13-17-5-3-11-25-17)14-18-6-4-12-27-18/h3-12H,2,13-14H2,1H3,(H,21,26)