Vitas-M small molecule compound
1,3-dibenzyl-4-(benzylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL441169
SMILES O=C(c1[n+](Cc2ccccc2)nn(c1[O-])Cc1ccccc1)NCc1ccccc1
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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 C24H22N4O2 MW 398.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O2/c29-23(25-16-19-10-4-1-5-11-19)22-24(30)28(18-21-14-8-3-9-15-21)26-27(22)17-20-12-6-2-7-13-20/h1-15H,16-18H2,(H-,25,26,29,30)InChIKey
GONNDZVGKYDHOD-UHFFFAOYSA-NSynonyms
1101875-17-51101875175
13dibenzyl4(benzylcarbamoyl)1H123triazol3ium5olate
13DIBENZYL5((BENZYLAMINO)CARBONYL)3H123TRIAZOL1IUM4OLATE
13DIBENZYL5(BENZYLCARBAMOYL)TRIAZOL3IUM4OLATE
C1=CC=C(C=C1)CNC(=O)C2=C((N+)(=NN2CC3=CC=CC=C3)CC4=CC=CC=C4)(O)
InChI=1SC24H22N4O2c2923(251619104151119)2224(30)28(1821148391521)2627(22)1720126271320h115H1618H2(H25262930)
MFCD07773674
O=C(c1(n+)(Cc2ccccc2)nn(c1(O))Cc1ccccc1)NCc1ccccc1
ZINC000003765447
ZINC03765447
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