Vitas-M small molecule compound
N-{[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK243898
SMILES S=C(NC(=O)c1ccc2c(c1)OCCO2)Nc1ccc2c(c1)nc(o2)c1cc(I)ccc1Cl
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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 C23H15ClIN3O4S MW 591.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClIN3O4S/c24-16-4-2-13(25)10-15(16)22-27-17-11-14(3-6-18(17)32-22)26-23(33)28-21(29)12-1-5-19-20(9-12)31-8-7-30-19/h1-6,9-11H,7-8H2,(H2,26,28,29,33)InChIKey
KHIWTHVJYOZSMU-UHFFFAOYSA-NSynonyms
C1COC2=C(O1)C=CC(=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)I)Cl
InChI=1SC23H15ClIN3O4Sc24164213(25)1015(16)2227171114(3618(17)3222)2623(33)2821(29)12151920(912)31873019h16911H78H2(H226282933)
MFCD03762611
N((2(2chloro5iodophenyl)13benzoxazol5yl)carbamothioyl)23dihydro14benzodioxine6carboxamide
ZINC000097948672
ZINC97948672
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