Vitas-M small molecule compound

3-{[3-(methoxycarbonyl)-5-methyl-4-phenylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Catalog ID
STL504368
SMILES COC(=O)c1c(NC(=O)C2C3C=CC(C2C(=O)O)C3)sc(c1c1ccccc1)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 C22H21NO5S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S/c1-11-15(12-6-4-3-5-7-12)18(22(27)28-2)20(29-11)23-19(24)16-13-8-9-14(10-13)17(16)21(25)26/h3-9,13-14,16-17H,10H2,1-2H3,(H,23,24)(H,25,26)
InChIKey
XDSFXTQCNVBYLR-UHFFFAOYSA-N
Synonyms

17377725
3((3(methoxycarbonyl)5methyl4phenylthiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3((3methoxycarbonyl5methyl4phenylthiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(3(METHOXYCARBONYL)5METHYL4PHENYL2THIENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
InChI=1SC22H21NO5Sc11115(126435712)18(22(27)282)20(2911)2319(24)16138914(1013)17(16)21(25)26h3913141617H10H212H3(H2324)(H2526)
MFCD06027256
ZINC000102404971
ZINC000239433060

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Available files

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