methyl 5-[[(E)-N-[(2,6-diethylphenyl)amino]-C-prop-2-enylsulfanyl-carbonimidoyl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[(E)-N-[(2,6-diethylphenyl)amino]-C-prop-2-enylsulfanyl-carbonimidoyl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[(E)-C-allylsulfanyl-N-(2,6-diethylanilino)carbonimidoyl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[(E)-[(2,6-diethylphenyl)hydrazinylidene]-(prop-2-enylthio)methyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[(E)-N-(2,6-diethylanilino)-C-prop-2-enylsulfanylcarbonimidoyl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[(E)-C-(allylthio)-N-(2,6-diethylanilino)carbonimidoyl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NN=C(SCC=C)SCC2=CC=C(O2)C(=O)OC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N/N=C(\SCC=C)/SCC2=CC=C(O2)C(=O)OC

InChI

InChI=1S/C21H26N2O3S2/c1-5-13-27-21(28-14-17-11-12-18(26-17)20(24)25-4)23-22-19-15(6-2)9-8-10-16(19)7-3/h5,8-12,22H,1,6-7,13-14H2,2-4H3/b23-21+