Vitas-M small molecule compound
(3aS,6R)-2-(5-methoxy-1,3-benzothiazol-2-yl)-N-[2-(morpholin-4-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STK611159
SMILES COc1ccc2c(c1)nc(s2)N1C[C@@]23C(C1=O)C([C@@H](O3)C=C2)C(=O)NCCN1CCOCC1
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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 C23H26N4O5S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O5S/c1-30-14-2-3-17-15(12-14)25-22(33-17)27-13-23-5-4-16(32-23)18(19(23)21(27)29)20(28)24-6-7-26-8-10-31-11-9-26/h2-5,12,16,18-19H,6-11,13H2,1H3,(H,24,28)/t16-,18?,19?,23-/m1/s1InChIKey
ZHGXIFFJNWUJCY-ANVCCXGISA-NSynonyms
(3aS6R)2(5methoxy13benzothiazol2yl)N(2(morpholin4yl)ethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
(6R)2(5methoxybenzo(d)thiazol2yl)N(2morpholinoethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
COc1ccc2c(c1)nc(s2)N1C(C@)23(C@H)(C1=O)(C@@H)((C@H)(O3)C=C2)C(=O)NCCN1CCOCC1
COc1ccc2c(c1)nc(s2)N1C(C@@)23C(C1=O)C((C@@H)(O3)C=C2)C(=O)NCCN1CCOCC1
MFCD18246267
ZINC000020621988
ZINC000026599824
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