Vitas-M small molecule compound

(3-butyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid

Catalog ID
STK038899
SMILES CCCCn1c(=N)n(c2c1cccc2)CC(=O)O

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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 C13H17N3O2 MW 247.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O2/c1-2-3-8-15-10-6-4-5-7-11(10)16(13(15)14)9-12(17)18/h4-7,14H,2-3,8-9H2,1H3,(H,17,18)/b14-13-
InChIKey
UFHGIBUXAYYQPM-YPKPFQOOSA-N
Synonyms
443923-31-7
(3butyl2imino23dihydro1Hbenzimidazol1yl)aceticacid
2(3butyl2imino23dihydro1Hbenzo(d)imidazol1yl)aceticacidhydrobromide
443923317
CCCCn1c(=N)n(c2c1cccc2)CC(=O)O
CCCCn1c(=N)n(c2c1cccc2)CC(=O)OBr
MFCD01055046
STK038899
ZINC000002268121

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Available files

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