Vitas-M small molecule compound

3-(5,6-dimethyl-1H-benzimidazol-2-yl)-6-methyl-8-nitro-2H-chromen-2-one

Catalog ID
STL294218
SMILES Cc1cc2cc(c(=O)oc2c(c1)[N+](=O)[O-])c1[nH]c2c(n1)cc(c(c2)C)C

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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 C19H15N3O4 MW 349.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O4/c1-9-4-12-8-13(19(23)26-17(12)16(5-9)22(24)25)18-20-14-6-10(2)11(3)7-15(14)21-18/h4-8H,1-3H3,(H,20,21)
InChIKey
CKKPWTZDGSKZQB-UHFFFAOYSA-N
Synonyms

3(56dimethyl1Hbenzimidazol2yl)6methyl8nitro2Hchromen2one
3(56dimethyl1Hbenzimidazol2yl)6methyl8nitrochromen2one
CC1=CC(=C2C(=C1)C=C(C(=O)O2)C3=NC4=C(N3)C=C(C(=C4)C)C)(N+)(=O)(O)
Cc1cc2cc(c(=O)oc2c(c1)(N+)(=O)(O))c1(nH)c2c(n1)cc(c(c2)C)C
InChI=1SC19H15N3O4c19412813(19(23)2617(12)16(59)22(24)25)182014610(2)11(3)715(14)2118h48H13H3(H2021)
MFCD08087446
ZINC000007344354
ZINC07344354
ZINC7344354

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Available files

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