cyclopentane; (1S)-2-cyclopentylsulfanyl-1-phenyl-ethanamine; iron(2+)

Systemtic Name: cyclopentane; (1S)-2-cyclopentylsulfanyl-1-phenyl-ethanamine; iron(2+) Openeye Name: ferrous; cyclopentane; (1S)-2-cyclopentylsulfanyl-1-phenyl-ethanamine CAS Name: cyclopentane; (1S)-2-(cyclopentylthio)-1-phenylethanamine; iron(2+) IUPAC Name: cyclopentane; (1S)-2-cyclopentylsulfanyl-1-phenylethanamine; iron(2+) Traditional Name: ferrous; cyclopentane; [(1S)-2-(cyclopentylthio)-1-phenyl-ethyl]amine Formula: C18H19FeNS+2 MolecularWeight: 337.26016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CS[C]2[CH][CH][CH][CH]2)N.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](CS[C]2[CH][CH][CH][CH]2)N.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C13H14NS.C5H5.Fe/c14-13(11-6-2-1-3-7-11)10-15-12-8-4-5-9-12;1-2-4-5-3-1;/h1-9,13H,10,14H2;1-5H;/q;;+2/t13-;;/m1../s1