Vitas-M small molecule compound
2-{[5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylpropyl)acetamide
Catalog ID
STK306765
SMILES CCn1cc(c(n1)c1nnc(n1CC1CCCO1)SCC(=O)NCC(C)C)Cl
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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 C18H27ClN6O2S MW 426.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27ClN6O2S/c1-4-24-10-14(19)16(23-24)17-21-22-18(25(17)9-13-6-5-7-27-13)28-11-15(26)20-8-12(2)3/h10,12-13H,4-9,11H2,1-3H3,(H,20,26)InChIKey
RYSADFCVFMCLMC-UHFFFAOYSA-NSynonyms
1005586-66-21005586662
2((5(4chloro1ethyl1Hpyrazol3yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)N(2methylpropyl)acetamide
2((5(4chloro1ethylpyrazol3yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)N(2methylpropyl)acetamide
CCN1C=C(C(=N1)C2=NN=C(N2CC3CCCO3)SCC(=O)NCC(C)C)Cl
InChI=1SC18H27ClN6O2Sc14241014(19)16(2324)17212218(25(17)9136572713)281115(26)20812(2)3h101213H4911H213H3(H2026)
MFCD04130212
ZINC000002791793
ZINC000002791794
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