Vitas-M small molecule compound
6-(3-chloro-4-methoxyphenyl)-3-ethyl-N-(2-ethylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359931
SMILES CCc1nnc2n1NC(c1ccc(c(c1)Cl)OC)C(S2)C(=O)Nc1ccccc1CC
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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 C22H24ClN5O2S MW 457.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O2S/c1-4-13-8-6-7-9-16(13)24-21(29)20-19(14-10-11-17(30-3)15(23)12-14)27-28-18(5-2)25-26-22(28)31-20/h6-12,19-20,27H,4-5H2,1-3H3,(H,24,29)InChIKey
QLISPWXUGAFNHN-UHFFFAOYSA-NSynonyms
891037-46-06(3chloro4methoxyphenyl)3ethylN(2ethylphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
891037460
CCC1=CC=CC=C1NC(=O)C2C(NN3C(=NN=C3S2)CC)C4=CC(=C(C=C4)OC)Cl
InChI=1SC22H24ClN5O2Sc1413867916(13)2421(29)2019(14101117(303)15(23)1214)272818(52)252622(28)3120h612192027H45H213H3(H2429)
MFCD08098771
ZINC000009239170
ZINC000009239173
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