Vitas-M small molecule compound
tert-butyl 2-[5-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate
Catalog ID
STL349288
SMILES CCc1ccccc1NC(=O)CSc1nnc(o1)C1CCCN1C(=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 C21H28N4O4S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O4S/c1-5-14-9-6-7-10-15(14)22-17(26)13-30-19-24-23-18(28-19)16-11-8-12-25(16)20(27)29-21(2,3)4/h6-7,9-10,16H,5,8,11-13H2,1-4H3,(H,22,26)InChIKey
ZWVHFEIJZXCZBI-UHFFFAOYSA-NSynonyms
(S)tertbutyl2(5((2((2ethylphenyl)amino)2oxoethyl)thio)134oxadiazol2yl)pyrrolidine1carboxylate
CCC1=CC=CC=C1NC(=O)CSC2=NN=C(O2)C3CCCN3C(=O)OC(C)(C)C
CCc1ccccc1NC(=O)CSc1nnc(o1)(C@@H)1CCCN1C(=O)OC(C)(C)C
InChI=1SC21H28N4O4Sc15149671015(14)2217(26)133019242318(2819)161181225(16)20(27)2921(23)4h6791016H581113H214H3(H2226)
MFCD28032627
tertbutyl2(5((2((2ethylphenyl)amino)2oxoethyl)sulfanyl)134oxadiazol2yl)pyrrolidine1carboxylate
TERTBUTYL2(5(2(2ETHYLANILINO)2OXOETHYL)SULFANYL134OXADIAZOL2YL)PYRROLIDINE1CARBOXYLATE
ZINC000003883013
ZINC000027407273
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