N-[(2,4-dichlorophenyl)methyl]-N-propan-2-yl-imidazole-1-carboxamide; manganese(2+); dichloride

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-N-propan-2-yl-imidazole-1-carboxamide; manganese(2+); dichloride Openeye Name: manganous N-[(2,4-dichlorophenyl)methyl]-N-isopropyl-imidazole-1-carboxamide dichloride CAS Name: N-[(2,4-dichlorophenyl)methyl]-N-propan-2-yl-1-imidazolecarboxamide; manganese(2+); dichloride IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-N-propan-2-ylimidazole-1-carboxamide; manganese(2+); dichloride Traditional Name: manganous N-(2,4-dichlorobenzyl)-N-isopropyl-imidazole-1-carboxamide dichloride Formula: C56H60Cl10MnN12O4 MolecularWeight: 1374.621649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.[Cl-].[Cl-].[Mn+2]

Isomeric SMILES

CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.CC(C)N(CC1=C(C=C(C=C1)Cl)Cl)C(=O)N2C=CN=C2.[Cl-].[Cl-].[Mn+2]

InChI

InChI=1S/4C14H15Cl2N3O.2ClH.Mn/c4*1-10(2)19(14(20)18-6-5-17-9-18)8-11-3-4-12(15)7-13(11)16;;;/h4*3-7,9-10H,8H2,1-2H3;2*1H;/q;;;;;;+2/p-2