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-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL079754
SMILES C=CCn1c(SCC(=O)Nc2nc(c(s2)C(=O)OCC)C)nnc1c1sc(nc1C)N
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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 C18H21N7O3S3 MW 479.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N7O3S3/c1-5-7-25-14(12-9(3)20-16(19)30-12)23-24-18(25)29-8-11(26)22-17-21-10(4)13(31-17)15(27)28-6-2/h5H,1,6-8H2,2-4H3,(H2,19,20)(H,21,22,26)InChIKey
UGZGJIQAINUCCR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NN=C(N2CC=C)C3=C(N=C(S3)N)C)C
ethyl2((((5(2amino4methyl13thiazol5yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)4methyl13thiazole5carboxylate
ethyl2((2((5(2amino4methyl13thiazol5yl)4prop2enyl124triazol3yl)sulfanyl)acetyl)amino)4methyl13thiazole5carboxylate
ETHYL2(2(5(2AMINO4METHYL(13THIAZOL5YL))4PROP2ENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC18H21N7O3S3c1572514(129(3)2016(19)3012)232418(25)29811(26)22172110(4)13(3117)15(27)2862h5H168H224H3(H21920)(H212226)
MFCD06649668
ZINC000016755348
ZINC16755348
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