methyl 2-methyl-5-[[(3-methylsulfanylphenyl)amino]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[(3-methylsulfanylphenyl)amino]methyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[(3-methylsulfanylanilino)methyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[3-(methylthio)anilino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(3-methylsulfanylanilino)methyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[[3-(methylthio)anilino]methyl]furan-3-carboxylic acid methyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CNC2=CC(=CC=C2)SC)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CNC2=CC(=CC=C2)SC)C(=O)OC

InChI

InChI=1S/C15H17NO3S/c1-10-14(15(17)18-2)8-12(19-10)9-16-11-5-4-6-13(7-11)20-3/h4-8,16H,9H2,1-3H3