Vitas-M small molecule compound

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-ethyl-5-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Catalog ID
STK222027
SMILES CCn1c(nnc1SC(C(=O)Nc1sc(c(n1)C)C)C)CC(=O)Nc1ccc(cc1)F

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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 C20H23FN6O2S2 MW 462.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FN6O2S2/c1-5-27-16(10-17(28)23-15-8-6-14(21)7-9-15)25-26-20(27)31-13(4)18(29)24-19-22-11(2)12(3)30-19/h6-9,13H,5,10H2,1-4H3,(H,23,28)(H,22,24,29)
InChIKey
HQGPUJBNLKWBQH-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SC(C)C(=O)NC2=NC(=C(S2)C)C)CC(=O)NC3=CC=C(C=C3)F
InChI=1SC20H23FN6O2S2c152716(1017(28)23158614(21)7915)252620(27)3113(4)18(29)24192211(2)12(3)3019h6913H510H214H3(H2328)(H222429)
MFCD07401455
N(45dimethyl13thiazol2yl)2((4ethyl5(2((4fluorophenyl)amino)2oxoethyl)4H124triazol3yl)sulfanyl)propanamide
N(45DIMETHYL13THIAZOL2YL)2((4ETHYL5(2(4FLUOROANILINO)2OXOETHYL)124TRIAZOL3YL)SULFANYL)PROPANAMIDE
N(45DIMETHYLTHIAZOL2YL)2(4ETHYL5((4FLUOROPHENYLCARBAMOYL)METHYL)4H(124)TRIAZOL3YLSULFANYL)PROPIONAMIDE
ZINC000009303564
ZINC000009303567

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Available files

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