Vitas-M small molecule compound
3-phenyl-7-(3,4,5-triethoxyphenyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Catalog ID
STK242405
SMILES CCOc1cc(cc(c1OCC)OCC)c1nn2c(s1)nnc(c2=O)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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-4-28-16-12-15(13-17(29-5-2)19(16)30-6-3)20-25-26-21(27)18(23-24-22(26)31-20)14-10-8-7-9-11-14/h7-13H,4-6H2,1-3H3InChIKey
LJKWFQBAWHGKMF-UHFFFAOYSA-NSynonyms
3phenyl7(345triethoxyphenyl)(134)thiadiazolo(23c)(124)triazin4one
3phenyl7(345triethoxyphenyl)4H(134)thiadiazolo(23c)(124)triazin4one
CCOC1=CC(=CC(=C1OCC)OCC)C2=NN3C(=O)C(=NN=C3S2)C4=CC=CC=C4
InChI=1SC22H22N4O4Sc1428161215(1317(2952)19(16)3063)20252621(27)18(232422(26)3120)14108791114h713H46H213H3
MFCD08684143
ZINC000009227310
ZINC09227310
ZINC9227310
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