Vitas-M small molecule compound

9-(benzylsulfanyl)acenaphtho[1,2-e][1,2,4]triazine

Catalog ID
STK381628
SMILES c1ccc(cc1)CSc1nnc2c(n1)c1cccc3c1c2ccc3

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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 C20H13N3S MW 327.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3S/c1-2-6-13(7-3-1)12-24-20-21-18-15-10-4-8-14-9-5-11-16(17(14)15)19(18)22-23-20/h1-11H,12H2
InChIKey
IJPLZGGWLXJOMR-UHFFFAOYSA-N
Synonyms

9(benzylsulfanyl)acenaphtho(12e)(124)triazine
C1=CC=C(C=C1)CSC2=NC3=C(C4=CC=CC5=C4C3=CC=C5)N=N2
InChI=1SC20H13N3Sc12613(731)122420211815104814951116(17(14)15)19(18)222320h111H12H2
MFCD02321720
ZINC000004152202
ZINC04152202
ZINC4152202

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Available files

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