Vitas-M small molecule compound

1-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea

Catalog ID
STK846019
SMILES COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)Nc2ccccc2)/s1

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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/c1-23-13-9-8-11(10-14(13)24-2)15-20-21-17(25-15)19-16(22)18-12-6-4-3-5-7-12/h3-10H,1-2H3,(H2,18,19,21,22)
InChIKey
OAWNMFKNQTXQOF-UHFFFAOYSA-N
Synonyms
328286-38-0
((5(34DIMETHOXYPHENYL)(134THIADIAZOL2YL))AMINO)NBENZAMIDE
1((2E)5(34dimethoxyphenyl)134thiadiazol2(3H)ylidene)3phenylurea
1(5(34DIMETHOXYPHENYL)(134)THIADIAZOL2YL)3PHENYLUREA
1(5(34DIMETHOXYPHENYL)134THIADIAZOL2YL)3PHENYLUREA
328286380
COC1=C(C=C(C=C1)C2=NN=C(S2)NC(=O)NC3=CC=CC=C3)OC
COc1cc(ccc1OC)c1n(nH)c(=NC(=O)Nc2ccccc2)s1
InChI=1SC17H16N4O3Sc123139811(1014(13)242)15202117(2515)1916(22)18126435712h310H12H3(H218192122)
MFCD03798266
ZINC000018098026
ZINC01906692
ZINC03858069
ZINC18098026

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Available files

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