Vitas-M small molecule compound

2-{3-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propyl}-1H-isoindole-1,3(2H)-dione

Catalog ID
STK297952
SMILES O=C1N(CCCc2sc3n(n2)c(nn3)c2ccc(cc2)Cl)C(=O)c2c1cccc2

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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 C20H14ClN5O2S MW 423.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN5O2S/c21-13-9-7-12(8-10-13)17-22-23-20-26(17)24-16(29-20)6-3-11-25-18(27)14-4-1-2-5-15(14)19(25)28/h1-2,4-5,7-10H,3,6,11H2
InChIKey
CWLUKPQUEZYZTQ-UHFFFAOYSA-N
Synonyms
879564-63-3
2(3(3(4CHLOROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PROPYL)1HISOINDOLE13(2H)DIONE
2(3(3(4CHLOROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PROPYL)ISOINDOLE13DIONE
2(3(3(4chlorophenyl)(124)triazolo(34b)(134)thiadiazol6yl)propyl)isoindoline13dione
879564633
C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC3=NN4C(=NN=C4S3)C5=CC=C(C=C5)Cl
InChI=1SC20H14ClN5O2Sc21139712(81013)1722232026(17)2416(2920)63112518(27)14412515(14)19(25)28h1245710H3611H2
MFCD06786560
ZINC000009043592
ZINC09043592
ZINC9043592

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Available files

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