Vitas-M small molecule compound

N-{1-[5-({2-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide

Catalog ID
STK246145
SMILES CCn1c(SCC(=O)Nc2nnc(s2)C2CC2)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 C20H22FN7O2S2 MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FN7O2S2/c1-3-28-16(11(2)22-17(30)13-6-4-5-7-14(13)21)24-27-20(28)31-10-15(29)23-19-26-25-18(32-19)12-8-9-12/h4-7,11-12H,3,8-10H2,1-2H3,(H,22,30)(H,23,26,29)
InChIKey
GYWLJIJIPDSLIQ-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)NC2=NN=C(S2)C3CC3)C(C)NC(=O)C4=CC=CC=C4F
InChI=1SC20H22FN7O2S2c132816(11(2)2217(30)13645714(13)21)242720(28)311015(29)2319262518(3219)128912h471112H3810H212H3(H2230)(H232629)
MFCD08683788
N(1(5((2((5cyclopropyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)ethyl)2fluorobenzamide
N(1(5((5CYCLOPROPYL(134)THIADIAZOL2YLCARBAMOYL)METHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(5(2((5cyclopropyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl4ethyl124triazol3yl)ethyl)2fluorobenzamide
ZINC000009328883
ZINC000009328885

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Available files

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