Vitas-M small molecule compound
Catalog ID
STK593832
SMILES CCC([C@@H](c1nnc(o1)SCC(=O)Nc1ccc(cc1)Br)N)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 C15H19BrN4O2S MW 399.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19BrN4O2S/c1-3-9(2)13(17)14-19-20-15(22-14)23-8-12(21)18-11-6-4-10(16)5-7-11/h4-7,9,13H,3,8,17H2,1-2H3,(H,18,21)/t9?,13-/m0/s1InChIKey
KABOXXWBHJEGRM-NCWAPJAISA-NSynonyms
2((5((1S)1AMINO2METHYLBUTYL)134OXADIAZOL2YL)SULFANYL)N(4BROMOPHENYL)ACETAMIDE
2((5((1S2R)1amino2methylbutyl)134oxadiazol2yl)thio)N(4bromophenyl)acetamidehydrochloride
CCC((C@@H)(c1nnc(o1)SCC(=O)Nc1ccc(cc1)Br)N)C
CCC((C@@H)(c1nnc(o1)SCC(=O)Nc1ccc(cc1)Br)N)CCl
CCC(C)C(C1=NN=C(O1)SCC(=O)NC2=CC=C(C=C2)Br)N
InChI=1SC15H19BrN4O2Sc139(2)13(17)14192015(2214)23812(21)18116410(16)5711h47913H3817H212H3(H1821)t9?13m0s1
MFCD03848319
ZINC000002383932
ZINC000013749816
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