Vitas-M small molecule compound

N-{[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}-L-valyl-L-valine

Catalog ID
STK613642
SMILES CC([C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)F)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 C21H28FN3O5 MW 421.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28FN3O5/c1-11(2)17(20(28)24-18(12(3)4)21(29)30)23-19(27)13-9-16(26)25(10-13)15-7-5-14(22)6-8-15/h5-8,11-13,17-18H,9-10H2,1-4H3,(H,23,27)(H,24,28)(H,29,30)/t13?,17-,18-/m0/s1
InChIKey
CZYUBIYYIFUJPO-RHGDZWTLSA-N
Synonyms

(2S)2(((2S)2((1(4fluorophenyl)5oxopyrrolidine3carbonyl)amino)3methylbutanoyl)amino)3methylbutanoicacid
(2S)2((2S)2(1(4fluorophenyl)5oxopyrrolidine3carboxamido)3methylbutanamido)3methylbutanoicacid
CC((C@@H)(C(=O)N(C@H)(C(=O)O)C(C)C)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)F)C
CC(C)C(C(=O)NC(C(C)C)C(=O)O)NC(=O)C1CC(=O)N(C1)C2=CC=C(C=C2)F
InChI=1SC21H28FN3O5c111(2)17(20(28)2418(12(3)4)21(29)30)2319(27)13916(26)25(1013)157514(22)6815h5811131718H910H214H3(H2327)(H2428)(H2930)t13?1718m0s1
MFCD18246297
N((1(4fluorophenyl)5oxopyrrolidin3yl)carbonyl)LvalylLvaline
ZINC000005321717
ZINC000005321718

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Available files

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