Vitas-M small molecule compound
N-(3-nitrophenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Catalog ID
STK455345
SMILES S=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)Nc1cccc(c1)[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 C18H17F3N4O2S MW 410.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3N4O2S/c19-18(20,21)13-3-1-5-15(11-13)23-7-9-24(10-8-23)17(28)22-14-4-2-6-16(12-14)25(26)27/h1-6,11-12H,7-10H2,(H,22,28)InChIKey
SDRUSLWZTNWSPT-UHFFFAOYSA-NSynonyms
((3NITROPHENYL)AMINO)(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)METHANE1THIONE
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=S)NC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC18H17F3N4O2Sc1918(2021)1331515(1113)237924(10823)17(28)221442616(1214)25(26)27h161112H710H2(H2228)
MFCD04228453
N(3nitrophenyl)4(3(trifluoromethyl)phenyl)piperazine1carbothioamide
S=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)Nc1cccc(c1)(N+)(=O)(O)
ZINC000001118195
ZINC01118195
ZINC1118195
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