ethyl 4-(furan-2-ylcarbonyl)-3-methylsulfanyl-5-phenyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-(furan-2-ylcarbonyl)-3-methylsulfanyl-5-phenyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-(furan-2-carbonyl)-3-methylsulfanyl-5-phenyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-furanyl(oxo)methyl]-3-(methylthio)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-carbonyl)-3-methylsulfanyl-5-phenyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-furoyl)-3-(methylthio)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C2=CC=CC=C2)C(=O)C3=CC=CO3)SC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C2=CC=CC=C2)C(=O)C3=CC=CO3)SC

InChI

InChI=1S/C19H17NO4S/c1-3-23-19(22)16-18(25-2)14(17(21)13-10-7-11-24-13)15(20-16)12-8-5-4-6-9-12/h4-11,20H,3H2,1-2H3