Vitas-M small molecule compound
5-chloro-2-(methylsulfanyl)-N-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Catalog ID
STK882249
SMILES CSc1ncc(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 C17H14ClN5OS3 MW 435.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN5OS3/c1-25-15-19-10-12(18)13(20-15)14(24)21-16-22-23-17(27-16)26-9-5-8-11-6-3-2-4-7-11/h2-8,10H,9H2,1H3,(H,21,22,24)/b8-5+InChIKey
HBUXXZHNMJRZHR-VMPITWQZSA-NSynonyms
5chloro2(methylsulfanyl)N(5(((2E)3phenylprop2en1yl)sulfanyl)134thiadiazol2yl)pyrimidine4carboxamide
5CHLORO2(METHYLTHIO)N(5((3PHENYL2PROPEN1YL)THIO)134THIADIAZOL2YL)4PYRIMIDINECARBOXAMIDE
5CHLORO2METHYLSULFANYLN(5((E)3PHENYLPROP2ENYL)SULFANYL134THIADIAZOL2YL)PYRIMIDINE4CARBOXAMIDE
CSC1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)SCC=CC3=CC=CC=C3)Cl
CSc1ncc(c(n1)C(=O)Nc1nnc(s1)SCC=Cc1ccccc1)Cl
InChI=1SC17H14ClN5OS3c12515191012(18)13(2015)14(24)2116222317(2716)26958116324711h2810H9H21H3(H212224)b85+
MFCD06628744
ZINC000002881948
ZINC02881948
ZINC2881948
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