Vitas-M small molecule compound

5-(4-tert-butylphenyl)-4-{[(E)-(9-ethyl-9H-carbazol-3-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL150104
SMILES CCn1c2ccc(cc2c2c1cccc2)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

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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 C27H27N5S MW 453.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5S/c1-5-31-23-9-7-6-8-21(23)22-16-18(10-15-24(22)31)17-28-32-25(29-30-26(32)33)19-11-13-20(14-12-19)27(2,3)4/h6-17H,5H2,1-4H3,(H,30,33)/b28-17+
InChIKey
GSGOOOFYNCQUBK-OGLMXYFKSA-N
Synonyms
380433-35-2
380433352
CCn1c2ccc(cc2c2c1cccc2)C=Nn1c(=S)(nH)nc1c1ccc(cc1)C(C)(C)C
MFCD03803169
ZINC000002330973

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Available files

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