Vitas-M small molecule compound
6-(3-bromo-4-methoxyphenyl)-3-methyl-N-(2-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL358996
SMILES COc1ccc(cc1Br)C1Nn2c(SC1C(=O)Nc1ccccc1C)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 C20H20BrN5O2S MW 474.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrN5O2S/c1-11-6-4-5-7-15(11)22-19(27)18-17(13-8-9-16(28-3)14(21)10-13)25-26-12(2)23-24-20(26)29-18/h4-10,17-18,25H,1-3H3,(H,22,27)InChIKey
FGHMUNDXQRHDMI-UHFFFAOYSA-NSynonyms
874586-91-16(3bromo4methoxyphenyl)3methylN(2methylphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
874586911
CC1=CC=CC=C1NC(=O)C2C(NN3C(=NN=C3S2)C)C4=CC(=C(C=C4)OC)Br
InChI=1SC20H20BrN5O2Sc111645715(11)2219(27)1817(138916(283)14(21)1013)252612(2)232420(26)2918h410171825H13H3(H2227)
MFCD07433496
ZINC000009237762
ZINC000009237767
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