Vitas-M small molecule compound

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

Catalog ID
STL234895
SMILES CCCCSc1nnc(o1)C(Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)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 C21H28N4O3S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O3S/c1-5-6-11-29-20-25-24-18(27-20)17(23-19(26)28-21(2,3)4)12-14-13-22-16-10-8-7-9-15(14)16/h7-10,13,17,22H,5-6,11-12H2,1-4H3,(H,23,26)
InChIKey
CGOVICVGULLSKD-UHFFFAOYSA-N
Synonyms

(S)tertbutyl(1(5(butylthio)134oxadiazol2yl)2(1Hindol3yl)ethyl)carbamate
CCCCSC1=NN=C(O1)C(CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C
CCCCSc1nnc(o1)(C@H)(Cc1c(nH)c2c1cccc2)NC(=O)OC(C)(C)C
CCCCSc1nnc(o1)C(Cc1c(nH)c2c1cccc2)NC(=O)OC(C)(C)C
InChI=1SC21H28N4O3Sc156112920252418(2720)17(2319(26)2821(23)4)12141322161087915(14)16h710131722H561112H214H3(H2326)
MFCD24858483
tertbutyl(1(5(butylsulfanyl)134oxadiazol2yl)2(1Hindol3yl)ethyl)carbamate
TERTBUTYLN(1(5BUTYLSULFANYL134OXADIAZOL2YL)2(1HINDOL3YL)ETHYL)CARBAMATE
ZINC000002195154
ZINC000015975046

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Available files

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