Vitas-M small molecule compound
N-(4-fluorophenyl)-6-(4-methylphenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL360119
SMILES O=C(C1Sc2nnc(n2NC1c1ccc(cc1)C)COc1ccccc1)Nc1ccc(cc1)F
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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 C25H22FN5O2S MW 475.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN5O2S/c1-16-7-9-17(10-8-16)22-23(24(32)27-19-13-11-18(26)12-14-19)34-25-29-28-21(31(25)30-22)15-33-20-5-3-2-4-6-20/h2-14,22-23,30H,15H2,1H3,(H,27,32)InChIKey
DEQGYCQAPNMNOI-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C(SC3=NN=C(N3N2)COC4=CC=CC=C4)C(=O)NC5=CC=C(C=C5)F
InChI=1SC25H22FN5O2Sc1167917(10816)2223(24(32)2719131118(26)121419)3425292821(31(25)3022)1533205324620h214222330H15H21H3(H2732)
MFCD08575545
N(4fluorophenyl)6(4methylphenyl)3(phenoxymethyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009295352
ZINC000009295355
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