Vitas-M small molecule compound
4-chloro-N-{2-[5-({2-[(2,6-difluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK297758
SMILES O=C(Nc1c(F)cccc1F)CSc1nnc(n1C)CCNC(=O)c1ccc(cc1)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 C20H18ClF2N5O2S MW 465.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClF2N5O2S/c1-28-16(9-10-24-19(30)12-5-7-13(21)8-6-12)26-27-20(28)31-11-17(29)25-18-14(22)3-2-4-15(18)23/h2-8H,9-11H2,1H3,(H,24,30)(H,25,29)InChIKey
DFUBNZHLTANUIM-UHFFFAOYSA-NSynonyms
4chloroN(2(5((2((26difluorophenyl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)ethyl)benzamide
4CHLORON(2(5((26DIFLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ETHYL)BENZAMIDE
4chloroN(2(5(2(26difluoroanilino)2oxoethyl)sulfanyl4methyl124triazol3yl)ethyl)benzamide
CN1C(=NN=C1SCC(=O)NC2=C(C=CC=C2F)F)CCNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H18ClF2N5O2Sc12816(9102419(30)125713(21)8612)262720(28)311117(29)251814(22)32415(18)23h28H911H21H3(H2430)(H2529)
MFCD09961152
ZINC000013956676
ZINC13956676
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