Vitas-M small molecule compound
N-{1-[5-({2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide
Catalog ID
STK218992
SMILES O=C(Nc1sc(c(n1)C)C)CSc1nnc(n1C)C(NC(=O)c1ccccc1F)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 C19H21FN6O2S2 MW 448.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21FN6O2S2/c1-10-12(3)30-18(22-10)23-15(27)9-29-19-25-24-16(26(19)4)11(2)21-17(28)13-7-5-6-8-14(13)20/h5-8,11H,9H2,1-4H3,(H,21,28)(H,22,23,27)InChIKey
PVVYMKFHOPOSAC-UHFFFAOYSA-NSynonyms
CC1=C(SC(=N1)NC(=O)CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CC=C3F)C
InChI=1SC19H21FN6O2S2c11012(3)3018(2210)2315(27)92919252416(26(19)4)11(2)2117(28)13756814(13)20h5811H9H214H3(H2128)(H222327)
MFCD07398847
N(1(5((2((45DIMETHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(5(2((45DIMETHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
ZINC000009302350
ZINC000009302351
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