Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-N-(3-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propyl)acetamide
Catalog ID
STK685229
SMILES O=C(CN1CCN(CC1)Cc1ccccc1)NCCCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F
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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 C23H28F3N5O3 MW 479.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28F3N5O3/c24-23(25,26)19-7-8-20(21(15-19)31(33)34)27-9-4-10-28-22(32)17-30-13-11-29(12-14-30)16-18-5-2-1-3-6-18/h1-3,5-8,15,27H,4,9-14,16-17H2,(H,28,32)InChIKey
BVRPFQZAGRADPW-UHFFFAOYSA-NSynonyms
2(4benzylpiperazin1yl)N(3((2nitro4(trifluoromethyl)phenyl)amino)propyl)acetamide
2(4BENZYLPIPERAZIN1YL)N(3(2NITRO4(TRIFLUOROMETHYL)ANILINO)PROPYL)ACETAMIDE
C1CN(CCN1CC2=CC=CC=C2)CC(=O)NCCCNC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
InChI=1SC23H28F3N5O3c2423(2526)197820(21(1519)31(33)34)2794102822(32)1730131129(121430)16185213618h13581527H49141617H2(H2832)
MFCD05857954
O=C(CN1CCN(CC1)Cc1ccccc1)NCCCNc1ccc(cc1(N+)(=O)(O))C(F)(F)F
ZINC000012376414
ZINC12376414
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