ethyl 1-ethyl-5-phenylsulfanyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-ethyl-5-phenylsulfanyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-ethyl-5-phenylsulfanyl-pyrrole-3-carboxylate CAS Name: 1-ethyl-5-(phenylthio)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-5-phenylsulfanylpyrrole-3-carboxylate Traditional Name: 1-ethyl-5-(phenylthio)pyrrole-3-carboxylic acid ethyl ester Formula: C15H17NO2S MolecularWeight: 275.36598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1SC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCN1C=C(C=C1SC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C15H17NO2S/c1-3-16-11-12(15(17)18-4-2)10-14(16)19-13-8-6-5-7-9-13/h5-11H,3-4H2,1-2H3