Vitas-M small molecule compound
3-ethyl-N-(4-methylphenyl)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359768
SMILES CCc1nnc2n1NC(c1ccccc1)C(S2)C(=O)Nc1ccc(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 C20H21N5OS MW 379.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5OS/c1-3-16-22-23-20-25(16)24-17(14-7-5-4-6-8-14)18(27-20)19(26)21-15-11-9-13(2)10-12-15/h4-12,17-18,24H,3H2,1-2H3,(H,21,26)InChIKey
PYQLDQLNCLLYPZ-UHFFFAOYSA-NSynonyms
3ethylN(4methylphenyl)6phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4
InChI=1SC20H21N5OSc131622232025(16)2417(147546814)18(2720)19(26)211511913(2)101215h412171824H3H212H3(H2126)
MFCD08106992
ZINC000006811784
ZINC000006811787
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