3-butyl-1-(2-ethylsulfanylethyl)-2-phenyl-pyrrole

Systemtic Name: 3-butyl-1-(2-ethylsulfanylethyl)-2-phenyl-pyrrole Openeye Name: 3-butyl-1-(2-ethylsulfanylethyl)-2-phenyl-pyrrole CAS Name: 3-butyl-1-[2-(ethylthio)ethyl]-2-phenylpyrrole IUPAC Name: 3-butyl-1-(2-ethylsulfanylethyl)-2-phenylpyrrole Traditional Name: 3-butyl-1-[2-(ethylthio)ethyl]-2-phenyl-pyrrole Formula: C18H25NS MolecularWeight: 287.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C=C1)CCSCC)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(N(C=C1)CCSCC)C2=CC=CC=C2

InChI

InChI=1S/C18H25NS/c1-3-5-9-17-12-13-19(14-15-20-4-2)18(17)16-10-7-6-8-11-16/h6-8,10-13H,3-5,9,14-15H2,1-2H3