Vitas-M small molecule compound

trans-4-{[(N-{[(4R)-3-(tert-butoxycarbonyl)-1,3-thiazolidin-4-yl]carbonyl}-D-alanyl)amino]methyl}cyclohexanecarboxylic acid

Catalog ID
STL529917
SMILES O=C([C@H](NC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C)C)NC[C@@H]1CC[C@H](CC1)C(=O)O

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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 C20H33N3O6S MW 443.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H33N3O6S/c1-12(16(24)21-9-13-5-7-14(8-6-13)18(26)27)22-17(25)15-10-30-11-23(15)19(28)29-20(2,3)4/h12-15H,5-11H2,1-4H3,(H,21,24)(H,22,25)(H,26,27)/t12-,13-,14-,15+/m1/s1
InChIKey
RSCLXFAWZIXTNW-TUVASFSCSA-N
Synonyms

(1S4r)4(((S)2((R)3(tertbutoxycarbonyl)thiazolidine4carboxamido)propanamido)methyl)cyclohexanecarboxylicacid
InChI=1SC20H33N3O6Sc112(16(24)219135714(8613)18(26)27)2217(25)1510301123(15)19(28)2920(23)4h1215H511H214H3(H2124)(H2225)(H2627)t12131415+m1s1
O=C((C@@H)(NC(=O)(C@@H)1CSCN1C(=O)OC(C)(C)C)C)NC(C@@H)1CC(C@H)(CC1)C(=O)O
trans4(((N(((4R)3(tertbutoxycarbonyl)13thiazolidin4yl)carbonyl)Dalanyl)amino)methyl)cyclohexanecarboxylicacid
ZINC000252694905

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Available files

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