Vitas-M small molecule compound

4,5-dimethoxy-2-nitro-N-{2-[(tetrahydrofuran-2-ylmethyl)carbamoyl]phenyl}benzamide

Catalog ID
STK260507
SMILES COc1cc(C(=O)Nc2ccccc2C(=O)NCC2CCCO2)c(cc1OC)[N+](=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 C21H23N3O7 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O7/c1-29-18-10-15(17(24(27)28)11-19(18)30-2)21(26)23-16-8-4-3-7-14(16)20(25)22-12-13-6-5-9-31-13/h3-4,7-8,10-11,13H,5-6,9,12H2,1-2H3,(H,22,25)(H,23,26)
InChIKey
YOIIIIWJMRDQDV-UHFFFAOYSA-N
Synonyms
893223-90-0
(45DIMETHOXY2NITROPHENYL)N(2(N(OXOLAN2YLMETHYL)CARBAMOYL)PHENYL)CARBOXAMIDE
45dimethoxy2nitroN(2((tetrahydrofuran2ylmethyl)carbamoyl)phenyl)benzamide
45dimethoxy2nitroN(2(oxolan2ylmethylcarbamoyl)phenyl)benzamide
893223900
COC1=C(C=C(C(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3CCCO3)(N+)(=O)(O))OC
COc1cc(C(=O)Nc2ccccc2C(=O)NCC2CCCO2)c(cc1OC)(N+)(=O)(O)
InChI=1SC21H23N3O7c129181015(17(24(27)28)1119(18)302)21(26)2316843714(16)20(25)2212136593113h3478101113H56912H212H3(H2225)(H2326)
MFCD07151138
ZINC000009426474
ZINC000009426475

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Available files

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