tert-butyl 2-(5-methylfuran-2-yl)-5-(2-methylsulfanylethyl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-(5-methylfuran-2-yl)-5-(2-methylsulfanylethyl)pyrrole-1-carboxylate Openeye Name: tert-butyl 2-(5-methyl-2-furyl)-5-(2-methylsulfanylethyl)pyrrole-1-carboxylate CAS Name: 2-(5-methyl-2-furanyl)-5-[2-(methylthio)ethyl]-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(5-methylfuran-2-yl)-5-(2-methylsulfanylethyl)pyrrole-1-carboxylate Traditional Name: 2-(5-methyl-2-furyl)-5-[2-(methylthio)ethyl]pyrrole-1-carboxylic acid tert-butyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=CC=C(N2C(=O)OC(C)(C)C)CCSC

Isomeric SMILES

CC1=CC=C(O1)C2=CC=C(N2C(=O)OC(C)(C)C)CCSC

InChI

InChI=1S/C17H23NO3S/c1-12-6-9-15(20-12)14-8-7-13(10-11-22-5)18(14)16(19)21-17(2,3)4/h6-9H,10-11H2,1-5H3