Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-6-phenyl-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359945
SMILES CCCc1nnc2n1NC(c1ccccc1)C(S2)C(=O)Nc1cccc(c1C)Cl
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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 C21H22ClN5OS MW 427.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5OS/c1-3-8-17-24-25-21-27(17)26-18(14-9-5-4-6-10-14)19(29-21)20(28)23-16-12-7-11-15(22)13(16)2/h4-7,9-12,18-19,26H,3,8H2,1-2H3,(H,23,28)InChIKey
NKPFMPWDXKTYJX-UHFFFAOYSA-NSynonyms
874587-40-3874587403
CCCC1=NN=C2N1NC(C(S2)C(=O)NC3=C(C(=CC=C3)Cl)C)C4=CC=CC=C4
InChI=1SC21H22ClN5OSc1381724252127(17)2618(1495461014)19(2921)20(28)23161271115(22)13(16)2h47912181926H38H212H3(H2328)
MFCD07433537
N(3chloro2methylphenyl)6phenyl3propyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009239580
ZINC000009239583
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