Vitas-M small molecule compound
N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-[4-(3-fluoro-4-methoxybenzyl)piperazin-1-yl]-4-oxobutanamide
Catalog ID
STL057588
SMILES CCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2ccc(c(c2)F)OC)/s1
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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 C20H26FN5O3S MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26FN5O3S/c1-3-18-23-24-20(30-18)22-17(27)6-7-19(28)26-10-8-25(9-11-26)13-14-4-5-16(29-2)15(21)12-14/h4-5,12H,3,6-11,13H2,1-2H3,(H,22,24,27)InChIKey
KWRBRFCDQSDQFN-UHFFFAOYSA-NSynonyms
714929-99-4714929994
CCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F
CCc1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)Cc2ccc(c(c2)F)OC)s1
InChI=1SC20H26FN5O3Sc1318232420(3018)2217(27)6719(28)2610825(91126)13144516(292)15(21)1214h4512H361113H212H3(H222427)
MFCD05734924
N((2Z)5ETHYL134THIADIAZOL2(3H)YLIDENE)4(4(3FLUORO4METHOXYBENZYL)PIPERAZIN1YL)4OXOBUTANAMIDE
N(5ETHYL134THIADIAZOL2YL)4(4((3FLUORO4METHOXYPHENYL)METHYL)PIPERAZIN1YL)4OXOBUTANAMIDE
ZINC000020443783
ZINC20443783
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