Vitas-M small molecule compound
N-{1-[5-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-4-fluorobenzamide
Catalog ID
STK121606
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)OCC)nnc1C(C(C)C)NC(=O)c1ccc(cc1)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 C25H30FN5O3S MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30FN5O3S/c1-5-31-23(22(16(3)4)28-24(33)17-7-9-18(26)10-8-17)29-30-25(31)35-15-21(32)27-19-11-13-20(14-12-19)34-6-2/h7-14,16,22H,5-6,15H2,1-4H3,(H,27,32)(H,28,33)InChIKey
GXCFOXNZAXUUNG-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)OCC)C(C(C)C)NC(=O)C3=CC=C(C=C3)F
InChI=1SC25H30FN5O3Sc153123(22(16(3)4)2824(33)177918(26)10817)293025(31)351521(32)2719111320(141219)3462h7141622H5615H214H3(H2732)(H2833)
MFCD04214469
N(1(5((2((4ETHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)2METHYLPROPYL)4FLUOROBENZAMIDE
N(1(5(2(4ETHOXYANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)2METHYLPROPYL)4FLUOROBENZAMIDE
ZINC000009305326
ZINC000009305328
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