Vitas-M small molecule compound
(3R)-2,2-dimethyl-N-{(2S)-4-methyl-1-oxo-1-[(3-phenylpropyl)amino]pentan-2-yl}-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Catalog ID
STL533561
SMILES CC(C[C@@H](C(=O)NCCCc1ccccc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)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 C28H35N3O3S MW 493.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N3O3S/c1-18(2)17-22(24(32)29-16-10-13-19-11-6-5-7-12-19)30-25(33)23-28(3,4)35-27-21-15-9-8-14-20(21)26(34)31(23)27/h5-9,11-12,14-15,18,22-23,27H,10,13,16-17H2,1-4H3,(H,29,32)(H,30,33)/t22-,23+,27?/m0/s1InChIKey
DLSXBFKCAFBQHX-FOCHENRBSA-NSynonyms
956937-75-0(3~(R))22dimethyl~(N)((2~(S))4methyl1oxo1(3phenylpropylamino)pentan2yl)5oxo39~(b)dihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethylN((2S)4methyl1oxo1((3phenylpropyl)amino)pentan2yl)5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethylN((S)4methyl1oxo1((3phenylpropyl)amino)pentan2yl)5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
16406277
956937750
CC(C(C@@H)(C(=O)NCCCc1ccccc1)NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C
InChI=1SC28H35N3O3Sc118(2)1722(24(32)2916101319116571219)3025(33)2328(34)35272115981420(21)26(34)31(23)27h591112141518222327H10131617H214H3(H2932)(H3033)t2223+27?m0s1
ZINC000008876408
ZINC000012889366
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