Vitas-M small molecule compound

tert-butyl {1-[5-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-3-(methylsulfanyl)propyl}carbamate

Catalog ID
STL241859
SMILES CSCCC(c1nnc(o1)SCC(=O)Nc1ccccc1CC)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 C21H30N4O4S2 MW 466.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4O4S2/c1-6-14-9-7-8-10-15(14)22-17(26)13-31-20-25-24-18(28-20)16(11-12-30-5)23-19(27)29-21(2,3)4/h7-10,16H,6,11-13H2,1-5H3,(H,22,26)(H,23,27)
InChIKey
WDQWGOOTBZWDCF-UHFFFAOYSA-N
Synonyms

(S)tertbutyl(1(5((2((2ethylphenyl)amino)2oxoethyl)thio)134oxadiazol2yl)3(methylthio)propyl)carbamate
CCC1=CC=CC=C1NC(=O)CSC2=NN=C(O2)C(CCSC)NC(=O)OC(C)(C)C
CSCC(C@@H)(c1nnc(o1)SCC(=O)Nc1ccccc1CC)NC(=O)OC(C)(C)C
InChI=1SC21H30N4O4S2c16149781015(14)2217(26)133120252418(2820)16(1112305)2319(27)2921(23)4h71016H61113H215H3(H2226)(H2327)
MFCD24859146
tertbutyl(1(5((2((2ethylphenyl)amino)2oxoethyl)sulfanyl)134oxadiazol2yl)3(methylsulfanyl)propyl)carbamate
TERTBUTYLN(1(5(2(2ETHYLANILINO)2OXOETHYL)SULFANYL134OXADIAZOL2YL)3METHYLSULFANYLPROPYL)CARBAMATE
ZINC000004296058
ZINC000016001006

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Available files

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