1-(2-adamantyl)-3-[(E)-(5-nitrothiophen-2-yl)methylideneamino]thiourea; palladium(2+); dichloride

Systemtic Name: 1-(2-adamantyl)-3-[(E)-(5-nitrothiophen-2-yl)methylideneamino]thiourea; palladium(2+); dichloride Openeye Name: 1-(2-adamantyl)-3-[(E)-(5-nitro-2-thienyl)methyleneamino]thiourea; palladium(2+); dichloride CAS Name: 1-(2-adamantyl)-3-[(E)-(5-nitro-2-thiophenyl)methylideneamino]thiourea; palladium(2+); dichloride IUPAC Name: 1-(2-adamantyl)-3-[(E)-(5-nitrothiophen-2-yl)methylideneamino]thiourea; palladium(2+); dichloride Traditional Name: 1-(2-adamantyl)-3-[(E)-(5-nitro-2-thienyl)methyleneamino]thiourea; palladium(2+); dichloride Formula: C16H20Cl2N4O2PdS2 MolecularWeight: 541.8116

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=S)NN=CC4=CC=C(S4)[N+](=O)[O-].[Cl-].[Cl-].[Pd+2]

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=S)N/N=C/C4=CC=C(S4)[N+](=O)[O-].[Cl-].[Cl-].[Pd+2]

InChI

InChI=1S/C16H20N4O2S2.2ClH.Pd/c21-20(22)14-2-1-13(24-14)8-17-19-16(23)18-15-11-4-9-3-10(6-11)7-12(15)5-9;;;/h1-2,8-12,15H,3-7H2,(H2,18,19,23);2*1H;/q;;;+2/p-2/b17-8+;;;