Vitas-M small molecule compound

tert-butyl (2S)-2-[5-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate

Catalog ID
STL564241
SMILES O=C(Nc1ccc(cc1C)C)CSc1nnc(o1)[C@@H]1CCCN1C(=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/c1-13-8-9-15(14(2)11-13)22-17(26)12-30-19-24-23-18(28-19)16-7-6-10-25(16)20(27)29-21(3,4)5/h8-9,11,16H,6-7,10,12H2,1-5H3,(H,22,26)/t16-/m0/s1
InChIKey
CAUXBEUCVQKEPI-INIZCTEOSA-N
Synonyms
1164473-35-1
(2S)2(5((2(24DIMETHYLANILINO)2KETOETHYL)THIO)134OXADIAZOL2YL)PYRROLIDINE1CARBOXYLICACIDTERTBUTYLESTER
(2S)2(5((2(24DIMETHYLANILINO)2OXOETHYL)THIO)134OXADIAZOL2YL)1PYRROLIDINECARBOXYLICACIDTERTBUTYLESTER
(S)tertbutyl2(5((2((24dimethylphenyl)amino)2oxoethyl)thio)134oxadiazol2yl)pyrrolidine1carboxylate
1164473351
665128
InChI=1SC21H28N4O4Sc1138915(14(2)1113)2217(26)123019242318(2819)16761025(16)20(27)2921(34)5h891116H671012H215H3(H2226)t16m0s1
MFCD04008278
O=C(Nc1ccc(cc1C)C)CSc1nnc(o1)(C@@H)1CCCN1C(=O)OC(C)(C)C
tertbutyl(2S)2(5((2((24dimethylphenyl)amino)2oxoethyl)sulfanyl)134oxadiazol2yl)pyrrolidine1carboxylate
TERTBUTYL(2S)2(5(2((24DIMETHYLPHENYL)AMINO)2OXIDANYLIDENEETHYL)SULFANYL134OXADIAZOL2YL)PYRROLIDINE1CARBOXYLATE
TERTBUTYL(2S)2(5(2(24DIMETHYLANILINO)2OXOETHYL)SULFANYL134OXADIAZOL2YL)PYRROLIDINE1CARBOXYLATE
ZINC000004296161

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Available files

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