methyl 3-[5-[(E)-3-[(4-methylsulfanylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]propanoate

Systemtic Name: methyl 3-[5-[(E)-3-[(4-methylsulfanylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]propanoate Openeye Name: methyl 3-[5-[(E)-3-(4-methylsulfanylanilino)-3-oxo-prop-1-enyl]-2-furyl]propanoate CAS Name: 3-[5-[(E)-3-[4-(methylthio)anilino]-3-oxoprop-1-enyl]-2-furanyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-3-(4-methylsulfanylanilino)-3-oxoprop-1-enyl]furan-2-yl]propanoate Traditional Name: 3-[5-[(E)-3-keto-3-[4-(methylthio)anilino]prop-1-enyl]-2-furyl]propionic acid methyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(O1)C=CC(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

COC(=O)CCC1=CC=C(O1)/C=C/C(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H19NO4S/c1-22-18(21)12-8-15-6-5-14(23-15)7-11-17(20)19-13-3-9-16(24-2)10-4-13/h3-7,9-11H,8,12H2,1-2H3,(H,19,20)/b11-7+