Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-6-(4-ethoxyphenyl)-3-ethyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359866
SMILES CCOc1ccc(cc1)C1Nn2c(CC)nnc2SC1C(=O)Nc1cccc(c1C)Cl
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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 C22H24ClN5O2S MW 457.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O2S/c1-4-18-25-26-22-28(18)27-19(14-9-11-15(12-10-14)30-5-2)20(31-22)21(29)24-17-8-6-7-16(23)13(17)3/h6-12,19-20,27H,4-5H2,1-3H3,(H,24,29)InChIKey
LOOOOMBCOLLVDS-UHFFFAOYSA-NSynonyms
891032-47-6891032476
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=C(C(=CC=C3)Cl)C)C4=CC=C(C=C4)OCC
InChI=1SC22H24ClN5O2Sc141825262228(18)2719(1491115(121014)3052)20(3122)21(29)241786716(23)13(17)3h612192027H45H213H3(H2429)
MFCD08107021
N(3chloro2methylphenyl)6(4ethoxyphenyl)3ethyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009197610
ZINC000009197626
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