Vitas-M small molecule compound

ethyl 2-[({[5-(2-amino-4-methyl-1,3-thiazol-5-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK844944
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC=C)c2sc(nc2C)N)sc(c1C)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 C20H24N6O3S3 MW 492.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O3S3/c1-6-8-26-16(15-11(4)22-19(21)32-15)24-25-20(26)30-9-13(27)23-17-14(18(28)29-7-2)10(3)12(5)31-17/h6H,1,7-9H2,2-5H3,(H2,21,22)(H,23,27)
InChIKey
GLIOLZVNDBEIDK-UHFFFAOYSA-N
Synonyms
615282-58-1
2((2((4ALLYL5(2AMINO4METHYLTHIAZOL5YL)124TRIAZOL3YL)THIO)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLICACIDETHYLESTER
2((2((5(2AMINO4METHYL5THIAZOLYL)4PROP2ENYL124TRIAZOL3YL)THIO)1OXOETHYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLICACIDETHYLESTER
615282581
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(N2CC=C)C3=C(N=C(S3)N)C
ETHYL2((((4ALLYL5(2AMINO4METHYL13THIAZOL5YL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
ETHYL2((((4ALLYL5(2AMINO4METHYL13THIAZOL5YL)4H124TRIAZOL3YL)THIO)ACETYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
ethyl2((((5(2amino4methyl13thiazol5yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ETHYL2((2((5(2AMINO4METHYL13THIAZOL5YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ethyl2(2((4allyl5(2amino4methylthiazol5yl)4H124triazol3yl)thio)acetamido)45dimethylthiophene3carboxylate
ETHYL2(2((5(2AZANYL4METHYL13THIAZOL5YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ETHANOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2(5(2AMINO4METHYL(13THIAZOL5YL))4PROP2ENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC20H24N6O3S3c1682616(1511(4)2219(21)3215)242520(26)30913(27)231714(18(28)2972)10(3)12(5)3117h6H179H225H3(H22122)(H2327)
MFCD03847734
ZINC000001805286
ZINC01805286
ZINC1805286

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.