Vitas-M small molecule compound

N-[(1-{[(4S)-3-(tert-butoxycarbonyl)-1,3-thiazolidin-4-yl]carbonyl}-4-phenylpiperidin-4-yl)carbonyl]-L-alanine

Catalog ID
STK598986
SMILES C[C@@H](C(=O)O)NC(=O)C1(CCN(CC1)C(=O)[C@H]1CSCN1C(=O)OC(C)(C)C)c1ccccc1

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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 C24H33N3O6S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33N3O6S/c1-16(20(29)30)25-21(31)24(17-8-6-5-7-9-17)10-12-26(13-11-24)19(28)18-14-34-15-27(18)22(32)33-23(2,3)4/h5-9,16,18H,10-15H2,1-4H3,(H,25,31)(H,29,30)/t16-,18+/m0/s1
InChIKey
LHCOOACTUZDLLX-FUHWJXTLSA-N
Synonyms
1164457-81-1
(2S)2((1((4S)3((2METHYLPROPAN2YL)OXYCARBONYL)13THIAZOLIDINE4CARBONYL)4PHENYLPIPERIDINE4CARBONYL)AMINO)PROPANOICACID
(R)2(1((S)3(tertbutoxycarbonyl)thiazolidine4carbonyl)4phenylpiperidine4carboxamido)propanoicacid
1164457811
C(C@@H)(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)(C@H)1CSCN1C(=O)OC(C)(C)C)c1ccccc1
C(C@H)(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)(C@H)1CSCN1C(=O)OC(C)(C)C)c1ccccc1
CC(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)C2CSCN2C(=O)OC(C)(C)C)C3=CC=CC=C3
InChI=1SC24H33N3O6Sc116(20(29)30)2521(31)24(178657917)101226(131124)19(28)1814341527(18)22(32)3323(23)4h591618H1015H214H3(H2531)(H2930)t1618+m0s1
MFCD06595053
N((1(((4S)3(tertbutoxycarbonyl)13thiazolidin4yl)carbonyl)4phenylpiperidin4yl)carbonyl)Lalanine
ZINC000004295036
ZINC4295036

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.