cyclopentane; 4,4-dimethyl-2-(2-phenylsulfanylcyclopentyl)-5H-1,3-oxazole; iron(2+)

Systemtic Name: cyclopentane; 4,4-dimethyl-2-(2-phenylsulfanylcyclopentyl)-5H-1,3-oxazole; iron(2+) Openeye Name: ferrous; cyclopentane; 4,4-dimethyl-2-(2-phenylsulfanylcyclopentyl)-5H-oxazole CAS Name: cyclopentane; 4,4-dimethyl-2-[2-(phenylthio)cyclopentyl]-5H-oxazole; iron(2+) IUPAC Name: cyclopentane; 4,4-dimethyl-2-(2-phenylsulfanylcyclopentyl)-5H-1,3-oxazole; iron(2+) Traditional Name: ferrous; cyclopentane; 4,4-dimethyl-2-[2-(phenylthio)cyclopentyl]-2-oxazoline Formula: C21H21FeNOS+2 MolecularWeight: 391.30754

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=N1)[C]2[CH][CH][CH][C]2SC3=CC=CC=C3)C.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC1(COC(=N1)[C]2[CH][CH][CH][C]2SC3=CC=CC=C3)C.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C16H16NOS.C5H5.Fe/c1-16(2)11-18-15(17-16)13-9-6-10-14(13)19-12-7-4-3-5-8-12;1-2-4-5-3-1;/h3-10H,11H2,1-2H3;1-5H;/q;;+2