Vitas-M small molecule compound

ethyl 5-[(5-phenyl-1,2,4-triazin-3-yl)sulfanyl]-1,2,3-thiadiazole-4-carboxylate

Catalog ID
STL446586
SMILES CCOC(=O)c1nnsc1Sc1nncc(n1)c1ccccc1

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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 C14H11N5O2S2 MW 345.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N5O2S2/c1-2-21-12(20)11-13(23-19-17-11)22-14-16-10(8-15-18-14)9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChIKey
GHJITBLQEKBDGG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SN=N1)SC2=NC(=CN=N2)C3=CC=CC=C3
ethyl5((5phenyl124triazin3yl)sulfanyl)123thiadiazole4carboxylate
ETHYL5((5PHENYL124TRIAZIN3YL)SULFANYL)THIADIAZOLE4CARBOXYLATE
ETHYL5((5PHENYL124TRIAZIN3YL)THIO)123THIADIAZOLE4CARBOXYLATE
InChI=1SC14H11N5O2S2c122112(20)1113(23191711)22141610(8151814)9643579h38H2H21H3
MFCD06242677
ZINC000001417139
ZINC1417139

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Available files

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