Vitas-M small molecule compound

N-cyclopropyl-2-nitro-5-[4-(4-phenyl-5-propyl-1,3-thiazol-2-yl)piperazin-1-yl]aniline

Catalog ID
STK196659
SMILES CCCc1sc(nc1c1ccccc1)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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-2-6-23-24(18-7-4-3-5-8-18)27-25(33-23)29-15-13-28(14-16-29)20-11-12-22(30(31)32)21(17-20)26-19-9-10-19/h3-5,7-8,11-12,17,19,26H,2,6,9-10,13-16H2,1H3
InChIKey
MWEXWRYCAVXEQR-UHFFFAOYSA-N
Synonyms

CCCC1=C(N=C(S1)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC4CC4)C5=CC=CC=C5
CCCc1sc(nc1c1ccccc1)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
InChI=1SC25H29N5O2Sc1262324(187435818)2725(3323)29151328(141629)20111222(30(31)32)21(1720)261991019h35781112171926H269101316H21H3
MFCD02934423
NCYCLOPROPYL2NITRO5(4(4PHENYL5PROPYL13THIAZOL2YL)PIPERAZIN1YL)ANILINE
ZINC000009934322
ZINC09934322
ZINC9934322

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Available files

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