Vitas-M small molecule compound
6-(4-methoxyphenyl)-3-methyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL358909
SMILES COc1ccc(cc1)C1Nn2c(SC1C(=O)Nc1cccc(c1)C(F)(F)F)nnc2C
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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 C20H18F3N5O2S MW 449.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3N5O2S/c1-11-25-26-19-28(11)27-16(12-6-8-15(30-2)9-7-12)17(31-19)18(29)24-14-5-3-4-13(10-14)20(21,22)23/h3-10,16-17,27H,1-2H3,(H,24,29)InChIKey
BIDCRGJSUFAJCJ-UHFFFAOYSA-NSynonyms
6(4methoxyphenyl)3methylN(3(trifluoromethyl)phenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
CC1=NN=C2N1NC(C(S2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=C(C=C4)OC
InChI=1SC20H18F3N5O2Sc11125261928(11)2716(126815(302)9712)17(3119)18(29)241453413(1014)20(2122)23h310161727H12H3(H2429)
MFCD09426558
ZINC000009236845
ZINC000009236849
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