Vitas-M small molecule compound
methyl (2,2,2-trichloro-1-{[(5Z)-3-(4-methoxyphenyl)-2-phenyl-1,2,4-thiadiazol-5(2H)-ylidene]amino}ethyl)carbamate
Catalog ID
STK400693
SMILES COC(=O)NC(C(Cl)(Cl)Cl)/N=c\1/nc(n(s1)c1ccccc1)c1ccc(cc1)OC
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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 C19H17Cl3N4O3S MW 487.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17Cl3N4O3S/c1-28-14-10-8-12(9-11-14)15-23-17(30-26(15)13-6-4-3-5-7-13)24-16(19(20,21)22)25-18(27)29-2/h3-11,16H,1-2H3,(H,25,27)/b24-17-InChIKey
DCFPUQGQEVYYFS-ULJHMMPZSA-NSynonyms
648408-13-3648408133
COC(=O)NC(C(Cl)(Cl)Cl)N=c1nc(n(s1)c1ccccc1)c1ccc(cc1)OC
COC1=CC=C(C=C1)C2=NC(=NC(C(Cl)(Cl)Cl)NC(=O)OC)SN2C3=CC=CC=C3
InChI=1SC19H17Cl3N4O3Sc1281410812(91114)152317(3026(15)136435713)2416(19(2021)22)2518(27)292h31116H12H3(H2527)b2417
methyl(222trichloro1(((5Z)3(4methoxyphenyl)2phenyl124thiadiazol5(2H)ylidene)amino)ethyl)carbamate
methylN(222trichloro1((Z)(3(4methoxyphenyl)2phenyl124thiadiazol5ylidene)amino)ethyl)carbamate
MFCD05899488
ZINC000012378379
ZINC000012378380
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