Vitas-M small molecule compound
N-(furan-2-ylmethyl)-2-{[N-(2-methoxy-5-nitrophenyl)-N-(methylsulfonyl)glycyl]amino}benzamide
Catalog ID
STK358451
SMILES COc1ccc(cc1N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)NCc1ccco1)[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 C22H22N4O8S MW 502.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O8S/c1-33-20-10-9-15(26(29)30)12-19(20)25(35(2,31)32)14-21(27)24-18-8-4-3-7-17(18)22(28)23-13-16-6-5-11-34-16/h3-12H,13-14H2,1-2H3,(H,23,28)(H,24,27)InChIKey
TTXJQBPCMYTSHM-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)S(=O)(=O)C
COc1ccc(cc1N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)NCc1ccco1)(N+)(=O)(O)
InChI=1SC22H22N4O8Sc1332010915(26(29)30)1219(20)25(35(231)32)1421(27)2418843717(18)22(28)23131665113416h312H1314H212H3(H2328)(H2427)
MFCD05836909
N(FURAN2YLMETHYL)2((2(2METHOXYNMETHYLSULFONYL5NITROANILINO)ACETYL)AMINO)BENZAMIDE
N(FURAN2YLMETHYL)2((N(2METHOXY5NITROPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)BENZAMIDE
ZINC000002877503
ZINC02877503
ZINC2877503
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