Vitas-M small molecule compound

6-(4-fluorophenyl)-N-(4-methylbenzyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

Catalog ID
STL359155
SMILES O=C(C1Sc2nnc(n2NC1c1ccc(cc1)F)c1ccccc1)NCc1ccc(cc1)C

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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 C25H22FN5OS MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN5OS/c1-16-7-9-17(10-8-16)15-27-24(32)22-21(18-11-13-20(26)14-12-18)30-31-23(28-29-25(31)33-22)19-5-3-2-4-6-19/h2-14,21-22,30H,15H2,1H3,(H,27,32)
InChIKey
ZSVDHSSCHZDQAW-UHFFFAOYSA-N
Synonyms

6(4fluorophenyl)N((4methylphenyl)methyl)3phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
6(4fluorophenyl)N(4methylbenzyl)3phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
CC1=CC=C(C=C1)CNC(=O)C2C(NN3C(=NN=C3S2)C4=CC=CC=C4)C5=CC=C(C=C5)F
InChI=1SC25H22FN5OSc1167917(10816)152724(32)2221(18111320(26)141218)303123(282925(31)3322)195324619h214212230H15H21H3(H2732)
MFCD08098679
ZINC000009238540
ZINC000009238544

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Available files

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