Vitas-M small molecule compound
4-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-2-fluorophenyl)piperazine-1-carbothioamide
Catalog ID
STK841745
SMILES Clc1ccc(c(c1)F)NC(=S)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C19H19ClFN3O2S MW 407.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClFN3O2S/c20-14-2-3-16(15(21)10-14)22-19(27)24-7-5-23(6-8-24)11-13-1-4-17-18(9-13)26-12-25-17/h1-4,9-10H,5-8,11-12H2,(H,22,27)InChIKey
BRFIJKZVZUEUJP-UHFFFAOYSA-NSynonyms
327093-21-0(4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)((4CHLORO2FLUOROPHENYL)AMINO)METHANE1THIONE
327093210
4(13benzodioxol5ylmethyl)N(4chloro2fluorophenyl)piperazine1carbothioamide
4(BENZO(D)(13)DIOXOL5YLMETHYL)N(4CHLORO2FLUOROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=S)NC4=C(C=C(C=C4)Cl)F
InChI=1SC19H19ClFN3O2Sc20142316(15(21)1014)2219(27)247523(6824)1113141718(913)26122517h14910H581112H2(H2227)
MFCD02659538
ZINC000019867827
ZINC19867827
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