Vitas-M small molecule compound
5-(phenoxymethyl)-4-phenyl-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK508113
SMILES S=c1n(c2ccccc2)c(nn1C1c2ccccc2Oc2c1cccc2)COc1ccccc1
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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 C28H21N3O2S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O2S/c34-28-30(20-11-3-1-4-12-20)26(19-32-21-13-5-2-6-14-21)29-31(28)27-22-15-7-9-17-24(22)33-25-18-10-8-16-23(25)27/h1-18,27H,19H2InChIKey
IJZJUAIAIJAYCL-UHFFFAOYSA-NSynonyms
4PHENYL3(PHENOXYMETHYL)1XANTHEN9YL124TRIAZOLINE5THIONE
5(PHENOXYMETHYL)4PHENYL2(9HXANTHEN9YL)124TRIAZOLE3THIONE
5(phenoxymethyl)4phenyl2(9Hxanthen9yl)24dihydro3H124triazole3thione
C1=CC=C(C=C1)N2C(=NN(C2=S)C3C4=CC=CC=C4OC5=CC=CC=C35)COC6=CC=CC=C6
InChI=1SC28H21N3O2Sc342830(20113141220)26(193221135261421)2931(28)272215791724(22)3325181081623(25)27h11827H19H2
MFCD01630008
ZINC000008855084
ZINC08855084
ZINC8855084
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