Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 6-(1,3-benzothiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate
Catalog ID
STK671326
SMILES O=C(C1CC=CCC1C(=O)Nc1nc2c(s1)cccc2)OCC1CCCO1
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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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c23-18(22-20-21-16-9-3-4-10-17(16)27-20)14-7-1-2-8-15(14)19(24)26-12-13-6-5-11-25-13/h1-4,9-10,13-15H,5-8,11-12H2,(H,21,22,23)InChIKey
KZZBVJOVYOZMPX-UHFFFAOYSA-NSynonyms
(2S)TETRAHYDROFURAN2YLMETHYL(1R6R)6(13BENZOTHIAZOL2YLCARBAMOYL)CYCLOHEX3ENE1CARBOXYLATE
C1CC(OC1)COC(=O)C2CC=CCC2C(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC20H22N2O4Sc2318(222021169341017(16)2720)14712815(14)19(24)26121365112513h149101315H581112H2(H212223)
MFCD00554036
OXOLAN2YLMETHYL6(13BENZOTHIAZOL2YLCARBAMOYL)CYCLOHEX3ENE1CARBOXYLATE
OXOLAN2YLMETHYL6(NBENZOTHIAZOL2YLCARBAMOYL)CYCLOHEX3ENECARBOXYLATE
tetrahydrofuran2ylmethyl6(13benzothiazol2ylcarbamoyl)cyclohex3ene1carboxylate
ZINC000001088367
ZINC000247486905
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