Vitas-M small molecule compound

(3R)-2,2-dimethyl-5-oxo-N-[(2S)-1-oxo-1-(piperidin-1-yl)propan-2-yl]-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide

Catalog ID
STK575654
SMILES O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)N1CCCCC1

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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 C21H27N3O3S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S/c1-13(18(26)23-11-7-4-8-12-23)22-17(25)16-21(2,3)28-20-15-10-6-5-9-14(15)19(27)24(16)20/h5-6,9-10,13,16,20H,4,7-8,11-12H2,1-3H3,(H,22,25)/t13-,16+,20?/m0/s1
InChIKey
BVKJOTJPMBRDKG-DAHSEZPTSA-N
Synonyms
1173685-41-0
(3R)22dimethyl5oxoN((2S)1oxo1(piperidin1yl)propan2yl)2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethyl5oxoN((2S)1oxo1piperidin1ylpropan2yl)39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethyl5oxoN((S)1oxo1(piperidin1yl)propan2yl)2359btetrahydrothiazolo(23a)isoindole3carboxamide
1173685410
CC(C(=O)N1CCCCC1)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
InChI=1SC21H27N3O3Sc113(18(26)23117481223)2217(25)1621(23)2820151065914(15)19(27)24(16)20h56910131620H4781112H213H3(H2225)t1316+20?m0s1
O=C((C@@H)(NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C)N1CCCCC1
ZINC000005244964
ZINC000005244967

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Available files

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