Vitas-M small molecule compound

2-({4-phenyl-3-[(propan-2-yloxy)carbonyl]thiophen-2-yl}carbamoyl)cyclohexanecarboxylic acid

Catalog ID
STK453231
SMILES CC(OC(=O)c1c(scc1c1ccccc1)NC(=O)C1CCCCC1C(=O)O)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 C22H25NO5S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO5S/c1-13(2)28-22(27)18-17(14-8-4-3-5-9-14)12-29-20(18)23-19(24)15-10-6-7-11-16(15)21(25)26/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3,(H,23,24)(H,25,26)
InChIKey
IDLBJAWSPQZDTF-UHFFFAOYSA-N
Synonyms

2(((3(ISOPROPOXYCARBONYL)4PHENYL2THIENYL)AMINO)CARBONYL)CYCLOHEXANECARBOXYLICACID
2((4phenyl3((propan2yloxy)carbonyl)thiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2((4PHENYL3PROPAN2YLOXYCARBONYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2(N(3((METHYLETHYL)OXYCARBONYL)4PHENYL2THIENYL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
CC(C)OC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCCCC3C(=O)O
InChI=1SC22H25NO5Sc113(2)2822(27)1817(148435914)122920(18)2319(24)1510671116(15)21(25)26h358912131516H671011H212H3(H2324)(H2526)
MFCD02255021
ZINC000003864273
ZINC000003864276

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Available files

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