Vitas-M small molecule compound
2-({5-[(2,5-dimethylphenoxy)methyl]-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1,3-thiazol-2-yl)propanamide
Catalog ID
STK230688
SMILES O=C(C(Sc1nnc(n1C(C)C)COc1cc(C)ccc1C)C)Nc1nccs1
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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 C20H25N5O2S2 MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2S2/c1-12(2)25-17(11-27-16-10-13(3)6-7-14(16)4)23-24-20(25)29-15(5)18(26)22-19-21-8-9-28-19/h6-10,12,15H,11H2,1-5H3,(H,21,22,26)InChIKey
FLHFTOUUAOSJKO-UHFFFAOYSA-NSynonyms
2((5((25dimethylphenoxy)methyl)4(propan2yl)4H124triazol3yl)sulfanyl)N(13thiazol2yl)propanamide
2((5((25DIMETHYLPHENOXY)METHYL)4PROPAN2YL124TRIAZOL3YL)SULFANYL)N(13THIAZOL2YL)PROPANAMIDE
CC1=CC(=C(C=C1)C)OCC2=NN=C(N2C(C)C)SC(C)C(=O)NC3=NC=CS3
InChI=1SC20H25N5O2S2c112(2)2517(1127161013(3)6714(16)4)232420(25)2915(5)18(26)221921892819h6101215H11H215H3(H212226)
MFCD07791479
ZINC000009303849
ZINC000009303852
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