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

Catalog ID
STK573470
SMILES O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)N[C@H](C(=O)NCc1ccccc1)C(C)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 C28H34N4O4S MW 522.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N4O4S/c1-16(2)21(24(34)29-15-18-11-7-6-8-12-18)31-23(33)17(3)30-25(35)22-28(4,5)37-27-20-14-10-9-13-19(20)26(36)32(22)27/h6-14,16-17,21-22,27H,15H2,1-5H3,(H,29,34)(H,30,35)(H,31,33)/t17-,21-,22+,27?/m0/s1
InChIKey
DAZXGMCEQYWBRE-XYNHVBJHSA-N
Synonyms
1013755-10-6
(3R)N((2S)1(((2S)1(benzylamino)3methyl1oxobutan2yl)amino)1oxopropan2yl)22dimethyl5oxo39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)1(((S)1(benzylamino)3methyl1oxobutan2yl)amino)1oxopropan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
1013755106
CC(C)C(C(=O)NCC1=CC=CC=C1)NC(=O)C(C)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
InChI=1SC28H34N4O4Sc116(2)21(24(34)291518117681218)3123(33)17(3)3025(35)2228(45)372720141091319(20)26(36)32(22)27h6141617212227H15H215H3(H2934)(H3035)(H3133)t172122+27?m0s1
N(((3R)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindol3yl)carbonyl)LalanylNbenzylLvalinamide
O=C((C@@H)(NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C)N(C@H)(C(=O)NCc1ccccc1)C(C)C
ZINC000013592122
ZINC000013592125

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Available files

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