Vitas-M small molecule compound
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Catalog ID
STL242855
SMILES COc1ccc(cc1)c1sc(c(n1)C)C(=O)Nc1ccc2c(c1)OCCCO2
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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 C21H20N2O4S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4S/c1-13-19(28-21(22-13)14-4-7-16(25-2)8-5-14)20(24)23-15-6-9-17-18(12-15)27-11-3-10-26-17/h4-9,12H,3,10-11H2,1-2H3,(H,23,24)InChIKey
DOBZLVXDBBMBFP-UHFFFAOYSA-NSynonyms
1351689-81-01351689810
CC1=C(SC(=N1)C2=CC=C(C=C2)OC)C(=O)NC3=CC4=C(C=C3)OCCCO4
InChI=1SC21H20N2O4Sc11319(2821(2213)144716(252)8514)20(24)2315691718(1215)27113102617h4912H31011H212H3(H2324)
MFCD20536220
N(34dihydro2H15benzodioxepin7yl)2(4methoxyphenyl)4methyl13thiazole5carboxamide
N(34dihydro2Hbenzo(b)(14)dioxepin7yl)2(4methoxyphenyl)4methylthiazole5carboxamide
ZINC000015810173
ZINC15810173
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