Vitas-M small molecule compound

Catalog ID
STK592050
SMILES CCC([C@@H](c1nnc(o1)SCC(=O)c1ccc(cc1)Cl)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 C15H18ClN3O2S MW 339.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18ClN3O2S/c1-3-9(2)13(17)14-18-19-15(21-14)22-8-12(20)10-4-6-11(16)7-5-10/h4-7,9,13H,3,8,17H2,1-2H3/t9?,13-/m0/s1
InChIKey
ABQUFQQMQCPHOH-NCWAPJAISA-N
Synonyms
1164506-37-9
1164506379
2((5((1S)1amino2methylbutyl)134oxadiazol2yl)sulfanyl)1(4chlorophenyl)ethanone
2((5((1S2S)1amino2methylbutyl)134oxadiazol2yl)thio)1(4chlorophenyl)ethanone
2(5((S)1AMINO2METHYLBUTYL)(134)OXADIAZOL2YLSULFANYL)1(4CHLOROPHENYL)ETHANONE
CCC((C@@H)(c1nnc(o1)SCC(=O)c1ccc(cc1)Cl)N)C
CCC(C)C(C1=NN=C(O1)SCC(=O)C2=CC=C(C=C2)Cl)N
InChI=1SC15H18ClN3O2Sc139(2)13(17)14181915(2114)22812(20)104611(16)7510h47913H3817H212H3t9?13m0s1
MFCD06611442
ZINC000002353703
ZINC000007952004

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Available files

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