Vitas-M small molecule compound
N-(2-ethylphenyl)-6-(4-methoxyphenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL358921
SMILES CCc1ccccc1NC(=O)C1Sc2nnc(n2NC1c1ccc(cc1)OC)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 C21H23N5O2S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S/c1-4-14-7-5-6-8-17(14)22-20(27)19-18(15-9-11-16(28-3)12-10-15)25-26-13(2)23-24-21(26)29-19/h5-12,18-19,25H,4H2,1-3H3,(H,22,27)InChIKey
SEDSEPWXHHBJAW-UHFFFAOYSA-NSynonyms
CCC1=CC=CC=C1NC(=O)C2C(NN3C(=NN=C3S2)C)C4=CC=C(C=C4)OC
InChI=1SC21H23N5O2Sc1414756817(14)2220(27)1918(1591116(283)121015)252613(2)232421(26)2919h512181925H4H213H3(H2227)
MFCD09426547
N(2ethylphenyl)6(4methoxyphenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009236764
ZINC000009236768
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