Vitas-M small molecule compound
1,1'-[6-(1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)-2-methyl-5,6-dihydro-1,2,4,5-tetrazine-1,3(2H)-diyl]diethanone
Catalog ID
STK723662
SMILES Clc1ccc(cc1)N1N=C(C(=O)C)N(N(C1c1ccc2c(c1)OCO2)C(=O)C)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 C20H19ClN4O4 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O4/c1-12(26)19-22-24(16-7-5-15(21)6-8-16)20(25(13(2)27)23(19)3)14-4-9-17-18(10-14)29-11-28-17/h4-10,20H,11H2,1-3H3InChIKey
RLGNUIFXUXOZOH-UHFFFAOYSA-NSynonyms
353499-81-71(2acetyl3(13benzodioxol5yl)4(4chlorophenyl)1methyl3H1245tetrazin6yl)ethanone
11(6(13benzodioxol5yl)5(4chlorophenyl)2methyl56dihydro1245tetrazine13(2H)diyl)diethanone
11(6(benzo(d)(13)dioxol5yl)5(4chlorophenyl)2methyl56dihydro1245tetrazine13(2H)diyl)diethanone
353499817
CC(=O)C1=NN(C(N(N1C)C(=O)C)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)Cl
InChI=1SC20H19ClN4O4c112(26)192224(167515(21)6816)20(25(13(2)27)23(19)3)14491718(1014)29112817h41020H11H213H3
MFCD01882745
ZINC000002210030
ZINC000002210032
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