Vitas-M small molecule compound
4-methyl-5-(4-methyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1,3-thiazol-2-amine
Catalog ID
STL079653
SMILES Nc1nc(c(s1)c1nnc(n1C)SC/C=C/c1ccccc1)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 C16H17N5S2 MW 343.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5S2/c1-11-13(23-15(17)18-11)14-19-20-16(21(14)2)22-10-6-9-12-7-4-3-5-8-12/h3-9H,10H2,1-2H3,(H2,17,18)/b9-6+InChIKey
QIWCUHDQWAPEPT-RMKNXTFCSA-NSynonyms
4methyl5(4methyl5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazol3yl)13thiazol2amine
4METHYL5(4METHYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOL3YL)13THIAZOL2AMINE
5(5((2E)3PHENYLPROP2ENYLTHIO)4METHYL(124TRIAZOL3YL))4METHYL13THIAZOLE2YLAMINE
CC1=C(SC(=N1)N)C2=NN=C(N2C)SCC=CC3=CC=CC=C3
InChI=1SC16H17N5S2c11113(2315(17)1811)14192016(21(14)2)221069127435812h39H10H212H3(H21718)b96+
MFCD06405642
Nc1nc(c(s1)c1nnc(n1C)SCC=Cc1ccccc1)C
ZINC000002710638
ZINC02710638
ZINC2710638
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