Vitas-M small molecule compound
1,1'-[6-(4-cyclohexylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]diethanone
Catalog ID
STL268225
SMILES CC(=O)c1sc2nncn2n(c1c1ccc(cc1)C1CCCCC1)C(=O)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 C20H22N4O2S MW 382.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S/c1-13(25)19-18(24(14(2)26)23-12-21-22-20(23)27-19)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h8-12,15H,3-7H2,1-2H3InChIKey
QGGKIGZOCOWXCP-UHFFFAOYSA-NSynonyms
1(5ACETYL6(4CYCLOHEXYLPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZIN7YL)ETHANONE
11(6(4cyclohexylphenyl)5H(124)triazolo(34b)(134)thiadiazine57diyl)diethanone
CC(=O)C1=C(N(N2C=NN=C2S1)C(=O)C)C3=CC=C(C=C3)C4CCCCC4
InChI=1SC20H22N4O2Sc113(25)1918(24(14(2)26)2312212220(23)2719)1710816(91117)156435715h81215H37H212H3
MFCD06733122
ZINC000004518310
ZINC04518310
ZINC4518310
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