Vitas-M small molecule compound
N-[1-(4-ethyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]-2-fluorobenzamide
Catalog ID
STK197836
SMILES CCn1c(SCC(=O)N2CCN(CC2)c2ccccc2)nnc1C(NC(=O)c1ccccc1F)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 C25H29FN6O2S MW 496.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29FN6O2S/c1-3-32-23(18(2)27-24(34)20-11-7-8-12-21(20)26)28-29-25(32)35-17-22(33)31-15-13-30(14-16-31)19-9-5-4-6-10-19/h4-12,18H,3,13-17H2,1-2H3,(H,27,34)InChIKey
IIXXFXFHYIRRTI-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)N2CCN(CC2)C3=CC=CC=C3)C(C)NC(=O)C4=CC=CC=C4F
InChI=1SC25H29FN6O2Sc133223(18(2)2724(34)2011781221(20)26)282925(32)351722(33)31151330(141631)1995461019h41218H31317H212H3(H2734)
MFCD06632628
N(1(4ETHYL5((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(4ETHYL5(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
ZINC000009263783
ZINC000009263784
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