Vitas-M small molecule compound
2-({5-[(2,6-dimethylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
Catalog ID
STK219298
SMILES C=CCn1c(nnc1COc1c(C)cccc1C)SC(C(=O)Nc1scc(n1)C)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 C21H25N5O2S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S2/c1-6-10-26-17(11-28-18-13(2)8-7-9-14(18)3)24-25-21(26)30-16(5)19(27)23-20-22-15(4)12-29-20/h6-9,12,16H,1,10-11H2,2-5H3,(H,22,23,27)InChIKey
HHUNBELIVWDJOD-UHFFFAOYSA-NSynonyms
2((5((26DIMETHYLPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(4METHYL13THIAZOL2YL)PROPANAMIDE
2((5((26DIMETHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4METHYL13THIAZOL2YL)PROPANAMIDE
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2CC=C)SC(C)C(=O)NC3=NC(=CS3)C
InChI=1SC21H25N5O2S2c16102617(11281813(2)87914(18)3)242521(26)3016(5)19(27)23202215(4)122920h691216H11011H225H3(H222327)
MFCD07401532
ZINC000009302726
ZINC000009302731
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