4-[[4-[[4-[[4-[Bis(2-Chloroethyl)Amino]Benzoyl]Amino]-1-Methylimidazole-2-Carbonyl]Amino]-1-Methylimidazole-2-Carbonyl]Amino]-N-(2-Dimethylaminoethyl)-1-Methylimidazole-2-Carboxamide
[CAS# 147056-67-5]

Identification

• Name: 4-[[4-[[4-[[4-[Bis(2-Chloroethyl)Amino]Benzoyl]Amino]-1-Methylimidazole-2-Carbonyl]Amino]-1-Methylimidazole-2-Carbonyl]Amino]-N-(2-Dimethylaminoethyl)-1-Methylimidazole-2-Carboxamide
• Synonyms: 4-[[4-[[4-[[4-[Bis(2-Chloroethyl)Amino]Benzoyl]Amino]-1-Methyl-Imidazole-2-Carbonyl]Amino]-1-Methyl-Imidazole-2-Carbonyl]Amino]-N-(2-Dimethylaminoethyl)-1-Methyl-Imidazole-2-Carboxamide; 4-[[[4-[[[4-[[[4-[Bis(2-Chloroethyl)Amino]Phenyl]-Oxomethyl]Amino]-1-Methyl-2-Imidazolyl]-Oxomethyl]Amino]-1-Methyl-2-Imidazolyl]-Oxomethyl]Amino]-N-(2-Dimethylaminoethyl)-1-Methyl-2-Imidazolecarboxamide; 4-[[4-[[4-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Carbonylamino]-1-Methyl-Imidazol-2-Yl]Carbonylamino]-1-Methyl-Imidazol-2-Yl]Carbonylamino]-N-(2-Dimethylaminoethyl)-1-Methyl-Imidazole-2-Carboxamide
• Molecular Formula: C₃₀H₃₈Cl₂N₁₂O₄
• Molecular Weight: 701.61
• CAS Registry Number: 147056-67-5
• SMILES: C1=C(N=C([N]1C)C(=O)NC2=C[N](C(=N2)C(=O)NCCN(C)C)C)NC(=O)C3=NC(=C[N]3C)NC(=O)C4=CC=C(N(CCCl)CCCl)C=C4
• InChI: 1S/C30H38Cl2N12O4/c1-40(2)15-12-33-28(46)24-34-22(17-41(24)3)38-30(48)26-36-23(18-43(26)5)39-29(47)25-35-21(16-42(25)4)37-27(45)19-6-8-20(9-7-19)44(13-10-31)14-11-32/h6-9,16-18H,10-15H2,1-5H3,(H,33,46)(H,37,45)(H,38,48)(H,39,47)
• InChIKey: QTDSAAJVUBUGHT-UHFFFAOYSA-N

Properties

• Density: 1.431g/cm³ (Cal.)