Vitas-M small molecule compound
8-hydroxy-1-[(phenylcarbonyl)amino]-6-thiabicyclo[3.2.1]oct-4-yl benzoate
Catalog ID
STK693788
SMILES O=C(c1ccccc1)NC12CCC(C(C2O)SC1)OC(=O)c1ccccc1
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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 C21H21NO4S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4S/c23-18-17-16(26-20(25)15-9-5-2-6-10-15)11-12-21(18,13-27-17)22-19(24)14-7-3-1-4-8-14/h1-10,16-18,23H,11-13H2,(H,22,24)InChIKey
KTLCCBNUTRMVBR-UHFFFAOYSA-NSynonyms
(1R8S)1benzamido8hydroxy6thiabicyclo(321)octan4ylbenzoate
(1S4S5R8R)1(BENZOYLAMINO)8HYDROXY6THIABICYCLO(321)OCT4YLBENZOATE
(5BENZAMIDO8HYDROXY7THIABICYCLO(321)OCTAN2YL)BENZOATE
8hydroxy1((phenylcarbonyl)amino)6thiabicyclo(321)oct4ylbenzoate
8HYDROXY5(PHENYLCARBONYLAMINO)7THIABICYCLO(321)OCT2YLBENZOATE
C1CC2(CSC(C1OC(=O)C3=CC=CC=C3)C2O)NC(=O)C4=CC=CC=C4
InChI=1SC21H21NO4Sc23181716(2620(25)1595261015)111221(18132717)2219(24)147314814h110161823H1113H2(H2224)
MFCD00509013
O=C(c1ccccc1)N(C@@)12CCC(C((C@H)2O)SC1)OC(=O)c1ccccc1
ZINC000004027792
ZINC000245255684
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