Vitas-M small molecule compound
3-ethyl-N-(4-methoxyphenyl)-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359799
SMILES CCc1nnc2n1NC(c1ccc(cc1)C)C(S2)C(=O)Nc1ccc(cc1)OC
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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/c1-4-17-23-24-21-26(17)25-18(14-7-5-13(2)6-8-14)19(29-21)20(27)22-15-9-11-16(28-3)12-10-15/h5-12,18-19,25H,4H2,1-3H3,(H,22,27)InChIKey
BVICIGPCFQCMFB-UHFFFAOYSA-NSynonyms
3ethylN(4methoxyphenyl)6(4methylphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC=C(C=C3)OC)C4=CC=C(C=C4)C
InChI=1SC21H23N5O2Sc141723242126(17)2518(147513(2)6814)19(2921)20(27)221591116(283)121015h512181925H4H213H3(H2227)
MFCD08107062
ZINC000006811896
ZINC000006811899
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