Vitas-M small molecule compound
tert-butyl {1-[5-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-3-methylbutyl}carbamate
Catalog ID
STL232750
SMILES CC(CC(c1nnc(o1)SCC(=O)Nc1cccc(c1C)Cl)NC(=O)OC(C)(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 C21H29ClN4O4S MW 469.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29ClN4O4S/c1-12(2)10-16(24-19(28)30-21(4,5)6)18-25-26-20(29-18)31-11-17(27)23-15-9-7-8-14(22)13(15)3/h7-9,12,16H,10-11H2,1-6H3,(H,23,27)(H,24,28)InChIKey
PMECRQGELOGGOX-UHFFFAOYSA-NSynonyms
(S)tertbutyl(1(5((2((3chloro2methylphenyl)amino)2oxoethyl)thio)134oxadiazol2yl)3methylbutyl)carbamate
CC(C(C@@H)(c1nnc(o1)SCC(=O)Nc1cccc(c1C)Cl)NC(=O)OC(C)(C)C)C
CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(O2)C(CC(C)C)NC(=O)OC(C)(C)C
InChI=1SC21H29ClN4O4Sc112(2)1016(2419(28)3021(45)6)18252620(2918)311117(27)231597814(22)13(15)3h791216H1011H216H3(H2327)(H2428)
MFCD24858298
TERTBUTYL((1S)1(5((2((3CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)134OXADIAZOL2YL)3METHYLBUTYL)CARBAMATE
tertbutyl(1(5((2((3chloro2methylphenyl)amino)2oxoethyl)sulfanyl)134oxadiazol2yl)3methylbutyl)carbamate
TERTBUTYLN(1(5(2(3CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL134OXADIAZOL2YL)3METHYLBUTYL)CARBAMATE
ZINC000002207682
ZINC000015975062
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