Hymenialdisine

CAS Registry Number®

82005-12-7

CAS Name

Hymenialdisine

Molecular Formula

C11H10BrN5O2

Molecular Mass

324.13

Cite this Page

Hymenialdisine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=82005-12-7 (retrieved 2024-11-22) (CAS RN: 82005-12-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >250 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-10(19)17-11(13)16-7)1-2-14-9(18)8(5)15-6/h3,15H,1-2H2,(H,14,18)(H3,13,16,17,19)/b7-4-

InChIKey

InChIKey=ATBAETXFFCOZOY-DAXSKMNVSA-N

SMILES

O=C1C2=C(/C(/CCN1)=C\3/C(=O)N=C(N)N3)C=C(Br)N2

Canonical SMILES

O=C1N=C(N)NC1=C2C=3C=C(Br)NC3C(=O)NCC2

Other Names for this Substance

  • Pyrrolo[2,3-c]azepin-8(1H)-one, 4-(2-amino-1,5-dihydro-5-oxo-4H-imidazol-4-ylidene)-2-bromo-4,5,6,7-tetrahydro-, (4Z)-
  • Pyrrolo[2,3-c]azepin-8(1H)-one, 4-(2-amino-1,5-dihydro-5-oxo-4H-imidazol-4-ylidene)-2-bromo-4,5,6,7-tetrahydro-, (Z)-
  • (4Z)-4-(2-Amino-1,5-dihydro-5-oxo-4H-imidazol-4-ylidene)-2-bromo-4,5,6,7-tetrahydropyrrolo[2,3-c]azepin-8(1H)-one
  • Hymenialdisine
  • (Z)-Hymenialdisine

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Deleted or Replaced CAS Registry Numbers

84094-93-9

CAS INSIGHTSTM
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