Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: 1H-1,2,4-Triazole-3-carboxamide
CAS No.: 3641-08-5
Molecular formula: C3H4N4O
Molecular weight: 112.09 g/mol
SMILES: C1=NNC(=N1)C(=O)N
Structural class:
Other identifiers:

1,2,4-triazole-3-carboxamide

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 20mg Purity≥98% 240 RT in stock -
Kehua Intelligence 1g 98% 28 RT in stock -
Kehua Intelligence 5g 98% 116 RT in stock -
Kehua Intelligence 25g 98% 400 RT in stock -
Kehua Intelligence 100g 98% 1520 RT in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

1H-1,2,4-triazole-5-carboxamide


4.2 InChI

InChI=1S/C3H4N4O/c4-2(8)3-5-1-6-7-3/h1H,(H2,4,8)(H,5,6,7)


4.3 InChIKey

ZEWJFUNFEABPGL-UHFFFAOYSA-N


4.4 Canonical SMILES

C1=NNC(=N1)C(=O)N


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon