Vitas-M small molecule compound
3-{[4-(pyrrolidin-1-ylsulfonyl)phenyl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK469989
SMILES O=C(C1C2CCC(C1C(=O)O)O2)Nc1ccc(cc1)S(=O)(=O)N1CCCC1
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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 C18H22N2O6S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O6S/c21-17(15-13-7-8-14(26-13)16(15)18(22)23)19-11-3-5-12(6-4-11)27(24,25)20-9-1-2-10-20/h3-6,13-16H,1-2,7-10H2,(H,19,21)(H,22,23)InChIKey
OYNBLHHNRRTGQJ-UHFFFAOYSA-NSynonyms
2((4pyrrolidin1ylsulfonylphenyl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((4(pyrrolidin1ylsulfonyl)phenyl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(N(4(PYRROLIDINYLSULFONYL)PHENYL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3C4CCC(C3C(=O)O)O4
InChI=1SC18H22N2O6Sc2117(15137814(2613)16(15)18(22)23)19113512(6411)27(2425)209121020h361316H12710H2(H1921)(H2223)
MFCD06063985
ZINC000225759751
ZINC000239173936
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