Vitas-M small molecule compound
4-(1,3-benzodioxol-5-ylmethyl)-N-[4-(difluoromethoxy)phenyl]piperazine-1-carbothioamide
Catalog ID
STK807255
SMILES FC(Oc1ccc(cc1)NC(=S)N1CCN(CC1)Cc1ccc2c(c1)OCO2)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 C20H21F2N3O3S MW 421.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F2N3O3S/c21-19(22)28-16-4-2-15(3-5-16)23-20(29)25-9-7-24(8-10-25)12-14-1-6-17-18(11-14)27-13-26-17/h1-6,11,19H,7-10,12-13H2,(H,23,29)InChIKey
RMOBWYKOSNFICL-UHFFFAOYSA-NSynonyms
473670-25-6(4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)((4(DIFLUOROMETHOXY)PHENYL)AMINO)METHANE1THIONE
4(13benzodioxol5ylmethyl)N(4(difluoromethoxy)phenyl)piperazine1carbothioamide
4(BENZO(D)(13)DIOXOL5YLMETHYL)N(4(DIFLUOROMETHOXY)PHENYL)PIPERAZINE1CARBOTHIOAMIDE
473670256
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=S)NC4=CC=C(C=C4)OC(F)F
InChI=1SC20H21F2N3O3Sc2119(22)28164215(3516)2320(29)259724(81025)1214161718(1114)27132617h161119H7101213H2(H2329)
MFCD03847631
ZINC000019911100
ZINC19911100
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