Vitas-M small molecule compound

4-benzyl-5-[4-(benzyloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL150236
SMILES S=c1[nH]nc(n1Cc1ccccc1)c1ccc(cc1)OCc1ccccc1

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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 C22H19N3OS MW 373.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3OS/c27-22-24-23-21(25(22)15-17-7-3-1-4-8-17)19-11-13-20(14-12-19)26-16-18-9-5-2-6-10-18/h1-14H,15-16H2,(H,24,27)
InChIKey
RPOQACUSXKIAES-UHFFFAOYSA-N
Synonyms
672889-22-4
4BENZYL3(4PHENYLMETHOXYPHENYL)1H124TRIAZOLE5THIONE
4benzyl5(4(benzyloxy)phenyl)24dihydro3H124triazole3thione
672889224
C1=CC=C(C=C1)CN2C(=NNC2=S)C3=CC=C(C=C3)OCC4=CC=CC=C4
InChI=1SC22H19N3OSc2722242321(25(22)15177314817)19111320(141219)26161895261018h114H1516H2(H2427)
MFCD03811367
S=c1(nH)nc(n1Cc1ccccc1)c1ccc(cc1)OCc1ccccc1
ZINC000002369882
ZINC01248300
ZINC02369882
ZINC2369882

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Available files

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