Vitas-M small molecule compound
N-cyclopropyl-5-{4-[(3,4-dimethoxyphenyl)sulfonyl]piperazin-1-yl}-2-nitroaniline
Catalog ID
STK172397
SMILES COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[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 C21H26N4O6S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O6S/c1-30-20-8-6-17(14-21(20)31-2)32(28,29)24-11-9-23(10-12-24)16-5-7-19(25(26)27)18(13-16)22-15-3-4-15/h5-8,13-15,22H,3-4,9-12H2,1-2H3InChIKey
QUFDYSOCMWEJQY-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC4CC4)OC
COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
InChI=1SC21H26N4O6Sc130208617(1421(20)312)32(2829)2411923(101224)165719(25(26)27)18(1316)22153415h58131522H34912H212H3
MFCD04377771
NCYCLOPROPYL5(4((34DIMETHOXYPHENYL)SULFONYL)PIPERAZIN1YL)2NITROANILINE
NCYCLOPROPYL5(4(34DIMETHOXYPHENYL)SULFONYLPIPERAZIN1YL)2NITROANILINE
ZINC000009891982
ZINC09891982
ZINC9891982
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