Vitas-M small molecule compound
methyl 1-[6-({2-[(2,4-difluorophenyl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-1H-imidazole-4-carboxylate
Catalog ID
STL124677
SMILES COC(=O)c1ncn(c1)c1ccc(nn1)SCC(=O)Nc1ccc(cc1F)F
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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 C17H13F2N5O3S MW 405.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F2N5O3S/c1-27-17(26)13-7-24(9-20-13)14-4-5-16(23-22-14)28-8-15(25)21-12-3-2-10(18)6-11(12)19/h2-7,9H,8H2,1H3,(H,21,25)InChIKey
FPUPVCZTDSXPFL-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=N1)C2=NN=C(C=C2)SCC(=O)NC3=C(C=C(C=C3)F)F
InChI=1SC17H13F2N5O3Sc12717(26)13724(92013)144516(232214)28815(25)21123210(18)611(12)19h279H8H21H3(H2125)
methyl1(6((2((24difluorophenyl)amino)2oxoethyl)sulfanyl)pyridazin3yl)1Himidazole4carboxylate
methyl1(6(2(24difluoroanilino)2oxoethyl)sulfanylpyridazin3yl)imidazole4carboxylate
MFCD20735603
ZINC000067240365
ZINC67240365
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