cyclopentane; 1-[(1R)-1-cyclopentyl-2-phenyl-ethyl]-3-(4-nitrophenyl)thiourea; iron(2+)

Systemtic Name: cyclopentane; 1-[(1R)-1-cyclopentyl-2-phenyl-ethyl]-3-(4-nitrophenyl)thiourea; iron(2+) Openeye Name: ferrous; cyclopentane; 1-[(1R)-1-cyclopentyl-2-phenyl-ethyl]-3-(4-nitrophenyl)thiourea CAS Name: cyclopentane; 1-[(1R)-1-cyclopentyl-2-phenylethyl]-3-(4-nitrophenyl)thiourea; iron(2+) IUPAC Name: cyclopentane; 1-[(1R)-1-cyclopentyl-2-phenylethyl]-3-(4-nitrophenyl)thiourea; iron(2+) Traditional Name: ferrous; cyclopentane; 1-[(1R)-1-cyclopentyl-2-phenyl-ethyl]-3-(4-nitrophenyl)thiourea Formula: C25H23FeN3O2S+2 MolecularWeight: 485.37902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC([C]2[CH][CH][CH][CH]2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-].[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]([C]2[CH][CH][CH][CH]2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-].[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C20H18N3O2S.C5H5.Fe/c24-23(25)18-12-10-17(11-13-18)21-20(26)22-19(16-8-4-5-9-16)14-15-6-2-1-3-7-15;1-2-4-5-3-1;/h1-13,19H,14H2,(H2,21,22,26);1-5H;/q;;+2/t19-;;/m1../s1