Vitas-M small molecule compound
2-({5-[(2,6-dimethylphenoxy)methyl]-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
Catalog ID
STK222151
SMILES Cc1csc(n1)NC(=O)C(Sc1nnc(n1C(C)C)COc1c(C)cccc1C)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 C21H27N5O2S2 MW 445.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2S2/c1-12(2)26-17(10-28-18-13(3)8-7-9-14(18)4)24-25-21(26)30-16(6)19(27)23-20-22-15(5)11-29-20/h7-9,11-12,16H,10H2,1-6H3,(H,22,23,27)InChIKey
LANLZFIFWYJKJY-UHFFFAOYSA-NSynonyms
2((5((26dimethylphenoxy)methyl)4(propan2yl)4H124triazol3yl)sulfanyl)N(4methyl13thiazol2yl)propanamide
2((5((26DIMETHYLPHENOXY)METHYL)4PROPAN2YL124TRIAZOL3YL)SULFANYL)N(4METHYL13THIAZOL2YL)PROPANAMIDE
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2C(C)C)SC(C)C(=O)NC3=NC(=CS3)C
InChI=1SC21H27N5O2S2c112(2)2617(10281813(3)87914(18)4)242521(26)3016(6)19(27)23202215(5)112920h79111216H10H216H3(H222327)
MFCD07403212
ZINC000009303874
ZINC000009303875
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