Vitas-M small molecule compound
ethyl 5-acetyl-4-methyl-2-[({[5-(1-methyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK302846
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)c2ccn(n2)C)sc(c1C)C(=O)C
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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 C23H28N6O5S2 MW 532.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N6O5S2/c1-5-33-22(32)18-13(2)19(14(3)30)36-21(18)24-17(31)12-35-23-26-25-20(16-8-9-28(4)27-16)29(23)11-15-7-6-10-34-15/h8-9,15H,5-7,10-12H2,1-4H3,(H,24,31)InChIKey
YWXMAMDJRRMQRI-UHFFFAOYSA-NSynonyms
1005615-73-51005615735
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CSC2=NN=C(N2CC3CCCO3)C4=NN(C=C4)C
ethyl5acetyl4methyl2((((5(1methyl1Hpyrazol3yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ETHYL5ACETYL4METHYL2((2((5(1METHYLPYRAZOL3YL)4(OXOLAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC23H28N6O5S2c153322(32)1813(2)19(14(3)30)3621(18)2417(31)123523262520(168928(4)2716)29(23)111576103415h8915H571012H214H3(H2431)
MFCD04049053
ZINC000097945624
ZINC000097945625
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