Vitas-M small molecule compound
3-[(2,4-dichlorophenoxy)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Catalog ID
STK968649
SMILES Clc1ccc(c(c1)Cl)OCc1nnc2n1CCCCC2
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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 C14H15Cl2N3O MW 312.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15Cl2N3O/c15-10-5-6-12(11(16)8-10)20-9-14-18-17-13-4-2-1-3-7-19(13)14/h5-6,8H,1-4,7,9H2InChIKey
JVNYZOJQUUWJHV-UHFFFAOYSA-NSynonyms
324578-42-924DICHLORO1(5H6H7H8H9H124TRIAZOLO(45A)AZAPERHYDROEPIN3YLMETHOXY)BENZENE
3((24dichlorophenoxy)methyl)6789tetrahydro5H(124)triazolo(43a)azepine
324578429
C1CCC2=NN=C(N2CC1)COC3=C(C=C(C=C3)Cl)Cl
InChI=1SC14H15Cl2N3Oc15105612(11(16)810)209141817134213719(13)14h568H1479H2
MFCD01848463
ZINC000002251542
ZINC02251542
ZINC2251542
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