Vitas-M small molecule compound
3-{[3-(cyclopentylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK470886
SMILES O=C(C1C2CCC(C1C(=O)O)O2)Nc1sc2c(c1C(=O)NC1CCCC1)CCC2
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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 C21H26N2O5S MW 418.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O5S/c24-18(22-10-4-1-2-5-10)15-11-6-3-7-14(11)29-20(15)23-19(25)16-12-8-9-13(28-12)17(16)21(26)27/h10,12-13,16-17H,1-9H2,(H,22,24)(H,23,25)(H,26,27)InChIKey
BPFSYJSIHHQYFS-UHFFFAOYSA-NSynonyms
2((3(cyclopentylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((3(cyclopentylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(N(3(NCYCLOPENTYLCARBAMOYL)456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
C1CCC(C1)NC(=O)C2=C(SC3=C2CCC3)NC(=O)C4C5CCC(C4C(=O)O)O5
InChI=1SC21H26N2O5Sc2418(2210412510)151163714(11)2920(15)2319(25)16128913(2812)17(16)21(26)27h1012131617H19H2(H2224)(H2325)(H2627)
MFCD06021515
ZINC000225764429
ZINC000239025432
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