Vitas-M small molecule compound

tert-butyl [1-{5-[(2-chloro-6-fluorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-2-(1H-indol-3-yl)ethyl]carbamate

Catalog ID
STL236030
SMILES O=C(OC(C)(C)C)NC(c1nnc(o1)SCc1c(F)cccc1Cl)Cc1c[nH]c2c1cccc2

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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 C24H24ClFN4O3S MW 503.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClFN4O3S/c1-24(2,3)33-22(31)28-20(11-14-12-27-19-10-5-4-7-15(14)19)21-29-30-23(32-21)34-13-16-17(25)8-6-9-18(16)26/h4-10,12,20,27H,11,13H2,1-3H3,(H,28,31)
InChIKey
DZONYOVZAPJGSV-UHFFFAOYSA-N
Synonyms

(S)tertbutyl(1(5((2chloro6fluorobenzyl)thio)134oxadiazol2yl)2(1Hindol3yl)ethyl)carbamate
CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C3=NN=C(O3)SCC4=C(C=CC=C4Cl)F
InChI=1SC24H24ClFN4O3Sc124(23)3322(31)2820(11141227191054715(14)19)21293023(3221)34131617(25)86918(16)26h410122027H1113H213H3(H2831)
MFCD24858595
O=C(OC(C)(C)C)N(C@H)(c1nnc(o1)SCc1c(F)cccc1Cl)Cc1c(nH)c2c1cccc2
O=C(OC(C)(C)C)NC(c1nnc(o1)SCc1c(F)cccc1Cl)Cc1c(nH)c2c1cccc2
tertbutyl(1(5((2chloro6fluorobenzyl)sulfanyl)134oxadiazol2yl)2(1Hindol3yl)ethyl)carbamate
TERTBUTYLN(1(5((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)134OXADIAZOL2YL)2(1HINDOL3YL)ETHYL)CARBAMATE
ZINC000002396958
ZINC000015987449

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.