Vitas-M small molecule compound

(3R)-N-[(2S)-1-{[2-(2-fluorophenyl)ethyl]amino}-1-oxopropan-2-yl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide

Catalog ID
STK607742
SMILES O=C([C@@H](NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)C)NCCc1ccccc1F

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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 C22H22FN3O3S MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN3O3S/c1-13(19(27)24-11-10-14-6-2-5-9-17(14)23)25-20(28)18-12-30-22-16-8-4-3-7-15(16)21(29)26(18)22/h2-9,13,18,22H,10-12H2,1H3,(H,24,27)(H,25,28)/t13-,18-,22?/m0/s1
InChIKey
ONCSEGNCWWQTKI-LUUADBQASA-N
Synonyms
1014000-81-7
(3R)N((2S)1((2(2fluorophenyl)ethyl)amino)1oxopropan2yl)5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((2S)1(2(2fluorophenyl)ethylamino)1oxopropan2yl)5oxo39bdihydro2H(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)1((2fluorophenethyl)amino)1oxopropan2yl)5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
1014000817
CC(C(=O)NCCC1=CC=CC=C1F)NC(=O)C2CSC3N2C(=O)C4=CC=CC=C34
InChI=1SC22H22FN3O3Sc113(19(27)24111014625917(14)23)2520(28)1812302216843715(16)21(29)26(18)22h29131822H1012H21H3(H2427)(H2528)t131822?m0s1
MFCD06771721
O=C((C@@H)(NC(=O)(C@@H)1CSC2N1C(=O)c1c2cccc1)C)NCCc1ccccc1F
ZINC000009447569
ZINC000009447577

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Available files

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