Vitas-M small molecule compound
N-(4-ethoxyphenyl)-3-ethyl-6-(4-methoxyphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359848
SMILES CCOc1ccc(cc1)NC(=O)C1Sc2nnc(n2NC1c1ccc(cc1)OC)CC
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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 C22H25N5O3S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3S/c1-4-18-24-25-22-27(18)26-19(14-6-10-16(29-3)11-7-14)20(31-22)21(28)23-15-8-12-17(13-9-15)30-5-2/h6-13,19-20,26H,4-5H2,1-3H3,(H,23,28)InChIKey
LKMNOGZVNQNSMB-UHFFFAOYSA-NSynonyms
891031-15-5891031155
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC=C(C=C3)OCC)C4=CC=C(C=C4)OC
InChI=1SC22H25N5O3Sc141824252227(18)2619(1461016(293)11714)20(3122)21(28)231581217(13915)3052h613192026H45H213H3(H2328)
MFCD08107087
N(4ethoxyphenyl)3ethyl6(4methoxyphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009197355
ZINC000009197376
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