Vitas-M small molecule compound

N-{[5-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-3-methoxybenzamide

Catalog ID
STK297256
SMILES COc1cccc(c1)C(=O)NCc1nnc(n1C)SCC(=O)Nc1ccccc1F

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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 C20H20FN5O3S MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN5O3S/c1-26-17(11-22-19(28)13-6-5-7-14(10-13)29-2)24-25-20(26)30-12-18(27)23-16-9-4-3-8-15(16)21/h3-10H,11-12H2,1-2H3,(H,22,28)(H,23,27)
InChIKey
FHEZNUPCSPPUHR-UHFFFAOYSA-N
Synonyms

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)CNC(=O)C3=CC(=CC=C3)OC
InChI=1SC20H20FN5O3Sc12617(112219(28)1365714(1013)292)242520(26)301218(27)2316943815(16)21h310H1112H212H3(H2228)(H2327)
MFCD09960846
N((5((2((2FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)3METHOXYBENZAMIDE
N((5(2(2fluoroanilino)2oxoethyl)sulfanyl4methyl124triazol3yl)methyl)3methoxybenzamide
N(5((2FLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)3METHOXYBENZAMIDE
ZINC000013956069
ZINC13956069

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Available files

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