Vitas-M small molecule compound

N-(1H-benzimidazol-2-ylmethyl)-1,3-benzodioxole-5-carboxamide

Catalog ID
STK781366
SMILES O=C(c1ccc2c(c1)OCO2)NCc1nc2c([nH]1)cccc2

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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 C16H13N3O3 MW 295.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3/c20-16(10-5-6-13-14(7-10)22-9-21-13)17-8-15-18-11-3-1-2-4-12(11)19-15/h1-7H,8-9H2,(H,17,20)(H,18,19)
InChIKey
HYHXAIROJHGKTA-UHFFFAOYSA-N
Synonyms
727997-85-5
727997855
C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4N3
InChI=1SC16H13N3O3c2016(10561314(710)2292113)178151811312412(11)1915h17H89H2(H1720)(H1819)
MFCD06014965
N(1Hbenzimidazol2ylmethyl)13benzodioxole5carboxamide
O=C(c1ccc2c(c1)OCO2)NCc1nc2c((nH)1)cccc2
ZINC000004625289
ZINC04625289
ZINC4625289

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Available files

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