Vitas-M small molecule compound
N-(2-hydroxy-5-methylphenyl)-2-{[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK267178
SMILES C=CCn1c(SCC(=O)Nc2cc(C)ccc2O)nnc1c1cccc(c1)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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-4-10-25-20(16-7-5-6-14(2)11-16)23-24-21(25)28-13-19(27)22-17-12-15(3)8-9-18(17)26/h4-9,11-12,26H,1,10,13H2,2-3H3,(H,22,27)InChIKey
VMNGOKBCKUMLCH-UHFFFAOYSA-NSynonyms
2(4ALLYL5MTOLYL4H(124)TRIAZOL3YLSULFANYL)N(2HYDROXY5METHYLPHENYL)ACETAMIDE
CC1=CC(=C(C=C1)O)NC(=O)CSC2=NN=C(N2CC=C)C3=CC(=CC=C3)C
InChI=1SC21H22N4O2Sc14102520(1675614(2)1116)232421(25)281319(27)22171215(3)8918(17)26h49111226H11013H223H3(H2227)
MFCD09267825
N(2HYDROXY5METHYLPHENYL)2((5(3METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2hydroxy5methylphenyl)2((5(3methylphenyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000009582901
ZINC09582901
ZINC9582901
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