Vitas-M small molecule compound
5-chloro-2-(ethylsulfonyl)-N-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Catalog ID
STK910401
SMILES CCS(=O)(=O)c1ncc(c(n1)C(=O)Nc1nnc(s1)SC/C=C/c1ccccc1)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 C18H16ClN5O3S3 MW 482.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN5O3S3/c1-2-30(26,27)17-20-11-13(19)14(21-17)15(25)22-16-23-24-18(29-16)28-10-6-9-12-7-4-3-5-8-12/h3-9,11H,2,10H2,1H3,(H,22,23,25)/b9-6+InChIKey
XWDBLVCGQHCNIZ-RMKNXTFCSA-NSynonyms
5chloro2(ethylsulfonyl)N(5(((2E)3phenylprop2en1yl)sulfanyl)134thiadiazol2yl)pyrimidine4carboxamide
5chloro2ethylsulfonylN(5((E)3phenylprop2enyl)sulfanyl134thiadiazol2yl)pyrimidine4carboxamide
CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)SCC=CC3=CC=CC=C3)Cl
CCS(=O)(=O)c1ncc(c(n1)C(=O)Nc1nnc(s1)SCC=Cc1ccccc1)Cl
InChI=1SC18H16ClN5O3S3c1230(2627)17201113(19)14(2117)15(25)2216232418(2916)281069127435812h3911H210H21H3(H222325)b96+
MFCD07425351
ZINC000008869041
ZINC08869041
ZINC8869041
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