Vitas-M small molecule compound

1-(3-methoxyphenyl)-3-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]urea

Catalog ID
STK098268
SMILES COc1cccc(c1)NC(=O)Nc1nnc(s1)COc1ccccc1

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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 C17H16N4O3S MW 356.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O3S/c1-23-14-9-5-6-12(10-14)18-16(22)19-17-21-20-15(25-17)11-24-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H2,18,19,21,22)
InChIKey
ZKJJJXBJQDMGTP-UHFFFAOYSA-N
Synonyms
426252-56-4
1(3METHOXYPHENYL)3(5(PHENOXYMETHYL)134THIADIAZOL2YL)UREA
426252564
COC1=CC=CC(=C1)NC(=O)NC2=NN=C(S2)COC3=CC=CC=C3
COc1cccc(c1)NC(=O)Nc1nnc(s1)COc1ccccc1
InChI=1SC17H16N4O3Sc1231495612(1014)1816(22)1917212015(2517)1124137324813h210H11H21H3(H218192122)
MFCD02639351
STK098268
ZINC000008743711
ZINC08743711
ZINC8743711

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.