Vitas-M small molecule compound
4-chloro-N-({5-[(2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)benzamide
Catalog ID
STK119163
SMILES O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1C)CNC(=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 C20H16Cl2F3N5O2S MW 518.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2F3N5O2S/c1-30-16(9-26-18(32)11-2-5-13(21)6-3-11)28-29-19(30)33-10-17(31)27-15-8-12(20(23,24)25)4-7-14(15)22/h2-8H,9-10H2,1H3,(H,26,32)(H,27,31)InChIKey
RSZUUTUTONRKAS-UHFFFAOYSA-NSynonyms
4CHLORON((5((2((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
4CHLORON((5(2(2CHLORO5(TRIFLUOROMETHYL)ANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)CNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H16Cl2F3N5O2Sc13016(92618(32)112513(21)6311)282919(30)331017(31)2715812(20(2324)25)4714(15)22h28H910H21H3(H2632)(H2731)
MFCD04127885
ZINC000001122324
ZINC1122324
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