Vitas-M small molecule compound

tert-butyl (2-{5-[(3-methylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}ethyl)carbamate

Catalog ID
STL341828
SMILES O=C(OC(C)(C)C)NCCc1nnc(o1)SCc1cccc(c1)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 C17H23N3O3S MW 349.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O3S/c1-12-6-5-7-13(10-12)11-24-16-20-19-14(22-16)8-9-18-15(21)23-17(2,3)4/h5-7,10H,8-9,11H2,1-4H3,(H,18,21)
InChIKey
BDLDZOHCDVSIHN-UHFFFAOYSA-N
Synonyms
585561-60-0
(2(5(3METHYLBENZYLSULFANYL)(134)OXADIAZOL2YL)ETHYL)CARBAMICACIDTERTBUTYLESTER
(TERTBUTOXY)N(2(5((3METHYLPHENYL)METHYLTHIO)(134OXADIAZOL2YL))ETHYL)CARBOXAMIDE
585561600
CC1=CC(=CC=C1)CSC2=NN=C(O2)CCNC(=O)OC(C)(C)C
InChI=1SC17H23N3O3Sc11265713(1012)112416201914(2216)891815(21)2317(23)4h5710H8911H214H3(H1821)
MFCD04030366
tertbutyl(2(5((3methylbenzyl)sulfanyl)134oxadiazol2yl)ethyl)carbamate
tertbutyl(2(5((3methylbenzyl)thio)134oxadiazol2yl)ethyl)carbamate
TERTBUTYLN(2(5((3METHYLPHENYL)METHYLSULFANYL)134OXADIAZOL2YL)ETHYL)CARBAMATE
ZINC000000532518
ZINC00532518
ZINC532518

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Available files

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