Vitas-M small molecule compound

[N'-(1H-benzimidazol-1-yl)carbamimidamido](imino)methanaminium

Catalog ID
STK379523
SMILES N=C(NC(=N)[NH3+])Nn1cnc2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C9H12N7 MW 218.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H11N7/c10-8(11)14-9(12)15-16-5-13-6-3-1-2-4-7(6)16/h1-5H,(H6,10,11,12,14,15)/p+1
InChIKey
KLKGKRILSQNKMH-UHFFFAOYSA-O
Synonyms

((E)N((E)N(benzimidazol1yl)carbamimidoyl)carbamimidoyl)azanium
(N(1Hbenzimidazol1yl)carbamimidamido)(imino)methanaminium
(N(N(BENZIMIDAZOL1YL)CARBAMIMIDOYL)CARBAMIMIDOYL)AZANIUM
C1=CC=C2C(=C1)N=CN2N=C(N)N=C((NH3+))N
InChI=1SC9H11N7c108(11)149(12)1516513631247(6)16h15H(H61011121415)p+1
MFCD11853190
N=C(NC(=N)(NH3+))Nn1cnc2c1cccc2
ZINC000004112789
ZINC22633098

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.