Vitas-M small molecule compound
N-(2-methoxy-5-methylphenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Catalog ID
STK464916
SMILES COc1ccc(cc1NC(=S)N1CCN(CC1)c1cccc(c1)C(F)(F)F)C
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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 C20H22F3N3OS MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22F3N3OS/c1-14-6-7-18(27-2)17(12-14)24-19(28)26-10-8-25(9-11-26)16-5-3-4-15(13-16)20(21,22)23/h3-7,12-13H,8-11H2,1-2H3,(H,24,28)InChIKey
QRMWAMFOSOSRNS-UHFFFAOYSA-NSynonyms
((2METHOXY5METHYLPHENYL)AMINO)(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)METHANE1THIONE
CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F
InChI=1SC20H22F3N3OSc1146718(272)17(1214)2419(28)2610825(91126)1653415(1316)20(2122)23h371213H811H212H3(H2428)
MFCD06029025
N(2methoxy5methylphenyl)4(3(trifluoromethyl)phenyl)piperazine1carbothioamide
ZINC000017088256
ZINC17088256
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