Urea, [[[[(2R,5S)-5-[3-[(aminoiminomethyl)amino]propyl]hexahydro-1-methyl-3,7-dioxo-1H-1,4-diazepin-2-yl]methyl]amino]iminomethyl]-

CAS Registry Number®

128126-46-5

CAS Name

Urea, [[[[(2R,5S)-5-[3-[(aminoiminomethyl)amino]propyl]hexahydro-1-methyl-3,7-dioxo-1H-1,4-diazepin-2-yl]methyl]amino]iminomethyl]-

Molecular Formula

C13H25N9O3

Molecular Mass

355.40

Cite this Page

Urea, [[[[(2R,5S)-5-[3-[(aminoiminomethyl)amino]propyl]hexahydro-1-methyl-3,7-dioxo-1H-1,4-diazepin-2-yl]methyl]amino]iminomethyl]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=128126-46-5 (retrieved 2025-01-05) (CAS RN: 128126-46-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H25N9O3/c1-22-8(6-19-12(16)21-13(17)25)10(24)20-7(5-9(22)23)3-2-4-18-11(14)15/h7-8H,2-6H2,1H3,(H,20,24)(H4,14,15,18)(H5,16,17,19,21,25)/t7-,8+/m0/s1

InChIKey

InChIKey=WXDPPHZLBSPZOA-JGVFFNPUSA-N

SMILES

C(NC(NC(N)=O)=N)[C@@H]1C(=O)N[C@@H](CCCNC(=N)N)CC(=O)N1C

Canonical SMILES

O=C(N)NC(=N)NCC1C(=O)NC(CC(=O)N1C)CCCNC(=N)N

Other Names for this Substance

  • Urea, [[[[(2R,5S)-5-[3-[(aminoiminomethyl)amino]propyl]hexahydro-1-methyl-3,7-dioxo-1H-1,4-diazepin-2-yl]methyl]amino]iminomethyl]-
  • Urea, [[[[5-[3-[(aminoiminomethyl)amino]propyl]hexahydro-1-methyl-3,7-dioxo-1H-1,4-diazepin-2-yl]methyl]amino]iminomethyl]-, (2R-trans)-
  • 1H-1,4-Diazepine, urea deriv.
  • TAN 1057C

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