Vitas-M small molecule compound
ethyl (2E)-2-{[({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL046592
SMILES CCOC(=O)c1s/c(=N/C(=O)CSc2nnc(o2)CSc2nc3c(s2)cccc3)/[nH]c1C
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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 C19H17N5O4S4 MW 507.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O4S4/c1-3-27-16(26)15-10(2)20-17(32-15)22-13(25)8-29-18-24-23-14(28-18)9-30-19-21-11-6-4-5-7-12(11)31-19/h4-7H,3,8-9H2,1-2H3,(H,20,22,25)InChIKey
IEKUEVWIRIUZEU-UHFFFAOYSA-NSynonyms
488119-56-8488119568
CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NN=C(O2)CSC3=NC4=CC=CC=C4S3)C
CCOC(=O)c1sc(=NC(=O)CSc2nnc(o2)CSc2nc3c(s2)cccc3)(nH)c1C
ethyl(2E)2((((5((13benzothiazol2ylsulfanyl)methyl)134oxadiazol2yl)sulfanyl)acetyl)imino)4methyl23dihydro13thiazole5carboxylate
ETHYL2((2((5(13BENZOTHIAZOL2YLSULFANYLMETHYL)134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2(2(5(BENZOTHIAZOL2YLTHIOMETHYL)(134OXADIAZOL2YLTHIO))ACETYLAMINO)4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC19H17N5O4S4c132716(26)1510(2)2017(3215)2213(25)82918242314(2818)930192111645712(11)3119h47H389H212H3(H202225)
MFCD03809275
ZINC17146868
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