methyl 5-methyl-1-(3-methylsulfanylphenyl)-2-oxidanylidene-3H-pyrrole-4-carboxylate

Systemtic Name: methyl 5-methyl-1-(3-methylsulfanylphenyl)-2-oxidanylidene-3H-pyrrole-4-carboxylate Openeye Name: methyl 5-methyl-1-(3-methylsulfanylphenyl)-2-oxo-3H-pyrrole-4-carboxylate CAS Name: 5-methyl-1-[3-(methylthio)phenyl]-2-oxo-3H-pyrrole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-1-(3-methylsulfanylphenyl)-2-oxo-3H-pyrrole-4-carboxylate Traditional Name: 5-keto-2-methyl-1-[3-(methylthio)phenyl]-2-pyrroline-3-carboxylic acid methyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=O)N1C2=CC(=CC=C2)SC)C(=O)OC

Isomeric SMILES

CC1=C(CC(=O)N1C2=CC(=CC=C2)SC)C(=O)OC

InChI

InChI=1S/C14H15NO3S/c1-9-12(14(17)18-2)8-13(16)15(9)10-5-4-6-11(7-10)19-3/h4-7H,8H2,1-3H3