Vitas-M small molecule compound
tert-butyl {1-[5-({2-[(3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-methylbutyl}carbamate
Catalog ID
STL234538
SMILES CCC(C(c1nnc(o1)SCC(=O)Nc1cccc(c1)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 C20H27ClN4O4S MW 454.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27ClN4O4S/c1-6-12(2)16(23-18(27)29-20(3,4)5)17-24-25-19(28-17)30-11-15(26)22-14-9-7-8-13(21)10-14/h7-10,12,16H,6,11H2,1-5H3,(H,22,26)(H,23,27)InChIKey
KSOGNQDYAOTGEQ-UHFFFAOYSA-NSynonyms
CCC((C@@H)(c1nnc(o1)SCC(=O)Nc1cccc(c1)Cl)NC(=O)OC(C)(C)C)C
CCC(C)C(C1=NN=C(O1)SCC(=O)NC2=CC(=CC=C2)Cl)NC(=O)OC(C)(C)C
InChI=1SC20H27ClN4O4Sc1612(2)16(2318(27)2920(34)5)17242519(2817)301115(26)221497813(21)1014h7101216H611H215H3(H2226)(H2327)
MFCD24858453
tertbutyl((1S2R)1(5((2((3chlorophenyl)amino)2oxoethyl)thio)134oxadiazol2yl)2methylbutyl)carbamate
tertbutyl(1(5((2((3chlorophenyl)amino)2oxoethyl)sulfanyl)134oxadiazol2yl)2methylbutyl)carbamate
TERTBUTYLN(1(5(2(3CHLOROANILINO)2OXOETHYL)SULFANYL134OXADIAZOL2YL)2METHYLBUTYL)CARBAMATE
ZINC000002386921
ZINC000015987272
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