Vitas-M small molecule compound
4,5-dimethoxy-2-nitro-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Catalog ID
STK260509
SMILES COc1cc(C(=O)Nc2nnc(s2)CCCc2ccccc2)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 C20H20N4O5S MW 428.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O5S/c1-28-16-11-14(15(24(26)27)12-17(16)29-2)19(25)21-20-23-22-18(30-20)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H,21,23,25)InChIKey
OIBXOGHXYYXFFK-UHFFFAOYSA-NSynonyms
893224-46-9(45DIMETHOXY2NITROPHENYL)N(5(3PHENYLPROPYL)(134THIADIAZOL2YL))CARBOXAMIDE
45dimethoxy2nitroN(5(3phenylpropyl)134thiadiazol2yl)benzamide
893224469
COC1=C(C=C(C(=C1)C(=O)NC2=NN=C(S2)CCCC3=CC=CC=C3)(N+)(=O)(O))OC
COc1cc(C(=O)Nc2nnc(s2)CCCc2ccccc2)c(cc1OC)(N+)(=O)(O)
InChI=1SC20H20N4O5Sc128161114(15(24(26)27)1217(16)292)19(25)2120232218(3020)1069137435813h35781112H6910H212H3(H212325)
MFCD07151145
ZINC000009426477
ZINC09426477
ZINC9426477
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