Vitas-M small molecule compound

3-[(1,3-dioxan-4-ylmethyl)sulfanyl]-4,5-diphenyl-4H-1,2,4-triazole

Catalog ID
STK733928
SMILES O1CCC(OC1)CSc1nnc(n1c1ccccc1)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 C19H19N3O2S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S/c1-3-7-15(8-4-1)18-20-21-19(22(18)16-9-5-2-6-10-16)25-13-17-11-12-23-14-24-17/h1-10,17H,11-14H2
InChIKey
ZQRUVANIBUOZDH-UHFFFAOYSA-N
Synonyms

13DIOXAN4YLMETHYL45DIPHENYL4H124TRIAZOL3YLSULFIDE
3((13dioxan4ylmethyl)sulfanyl)45diphenyl4H124triazole
3(13DIOXAN4YLMETHYLSULFANYL)45DIPHENYL124TRIAZOLE
3(13DIOXAN4YLMETHYLTHIO)45DIPHENYL124TRIAZOLE
C1COCOC1CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC19H19N3O2Sc13715(841)18202119(22(18)1695261016)251317111223142417h11017H1114H2
MFCD03133634
ZINC000000717803
ZINC000000717804

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Available files

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