Vitas-M small molecule compound

methyl 3-({[2-(formylamino)tricyclo[3.3.1.1~3,7~]dec-2-yl]carbonyl}amino)thiophene-2-carboxylate

Catalog ID
STK507483
SMILES O=CNC1(C2CC3CC1CC(C2)C3)C(=O)Nc1ccsc1C(=O)OC

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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 C18H22N2O4S MW 362.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O4S/c1-24-16(22)15-14(2-3-25-15)20-17(23)18(19-9-21)12-5-10-4-11(7-12)8-13(18)6-10/h2-3,9-13H,4-8H2,1H3,(H,19,21)(H,20,23)
InChIKey
HMRFFUSSGVPCFB-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C=CS1)NC(=O)C2(C3CC4CC(C3)CC2C4)NC=O
InChI=1SC18H22N2O4Sc12416(22)1514(232515)2017(23)18(19921)12510411(712)813(18)610h23913H48H21H3(H1921)(H2023)
methyl3(((2(formylamino)tricyclo(3311~37~)dec2yl)carbonyl)amino)thiophene2carboxylate
methyl3((2formamidoadamantane2carbonyl)amino)thiophene2carboxylate
MFCD13369414
ZINC000035170805
ZINC35170805

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Available files

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