Vitas-M small molecule compound

N-{[(3R)-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindol-3-yl]carbonyl}-L-leucyl-L-phenylalanine

Catalog ID
STL531378
SMILES CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)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 C28H33N3O5S MW 523.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O5S/c1-16(2)14-20(23(32)30-21(27(35)36)15-17-10-6-5-7-11-17)29-24(33)22-28(3,4)37-26-19-13-9-8-12-18(19)25(34)31(22)26/h5-13,16,20-22,26H,14-15H2,1-4H3,(H,29,33)(H,30,32)(H,35,36)/t20-,21-,22+,26?/m0/s1
InChIKey
PZFUOFXCIAKGCY-JJYZUEOJSA-N
Synonyms
956994-63-1
(2~(S))2(((2~(S))2(((3~(R))22dimethyl5oxo39~(b)dihydro(13)thiazolo(23a)isoindole3carbonyl)amino)4methylpentanoyl)amino)3phenylpropanoicacid
(2S)2((2S)2((3R)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamido)4methylpentanamido)3phenylpropanoicacid
16406361
956994631
CC(C(C@@H)(C(=O)N(C@H)(C(=O)O)Cc1ccccc1)NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C
InChI=1SC28H33N3O5Sc116(2)1420(23(32)3021(27(35)36)1517106571117)2924(33)2228(34)37261913981218(19)25(34)31(22)26h51316202226H1415H214H3(H2933)(H3032)(H3536)t202122+26?m0s1
N(((3R)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindol3yl)carbonyl)LleucylLphenylalanine
ZINC000008876489
ZINC000008876492

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Available files

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