Vitas-M small molecule compound

Catalog ID
STL002432
SMILES CCC([C@@H](c1nnc(o1)S(=O)(=O)Cc1cccc(c1)F)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 C19H26FN3O5S MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26FN3O5S/c1-6-12(2)15(21-17(24)28-19(3,4)5)16-22-23-18(27-16)29(25,26)11-13-8-7-9-14(20)10-13/h7-10,12,15H,6,11H2,1-5H3,(H,21,24)/t12?,15-/m0/s1
InChIKey
KOBUFEKEZOUFMN-CVRLYYSRSA-N
Synonyms

CC(C@H)((C@@H)(c1nnc(o1)S(=O)(=O)Cc1cccc(c1)F)NC(=O)OC(C)(C)C)C
CCC((C@@H)(c1nnc(o1)S(=O)(=O)Cc1cccc(c1)F)NC(=O)OC(C)(C)C)C
CCC(C)C(C1=NN=C(O1)S(=O)(=O)CC2=CC(=CC=C2)F)NC(=O)OC(C)(C)C
InChI=1SC19H26FN3O5Sc1612(2)15(2117(24)2819(34)5)16222318(2716)29(2526)111387914(20)1013h7101215H611H215H3(H2124)t12?15m0s1
MFCD18185355
tertbutyl((1S2R)1(5((3fluorobenzyl)sulfonyl)134oxadiazol2yl)2methylbutyl)carbamate
tertbutylN((1S)1(5((3fluorophenyl)methylsulfonyl)134oxadiazol2yl)2methylbutyl)carbamate
ZINC000002431447
ZINC000015999093

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Available files

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