Vitas-M small molecule compound
N-benzyl-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359039
SMILES O=C(C1Sc2nnc(n2NC1c1ccc(cc1)C)C)NCc1ccccc1
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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 C20H21N5OS MW 379.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5OS/c1-13-8-10-16(11-9-13)17-18(27-20-23-22-14(2)25(20)24-17)19(26)21-12-15-6-4-3-5-7-15/h3-11,17-18,24H,12H2,1-2H3,(H,21,26)InChIKey
GWJYBYCEVLOHLE-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C(SC3=NN=C(N3N2)C)C(=O)NCC4=CC=CC=C4
InChI=1SC20H21N5OSc11381016(11913)1718(2720232214(2)25(20)2417)19(26)2112156435715h311171824H12H212H3(H2126)
MFCD08098707
Nbenzyl3methyl6(4methylphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009238797
ZINC000009238800
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