Vitas-M small molecule compound
6-benzyl-2-[(3-methoxybenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Catalog ID
STK227569
SMILES COc1cccc(c1)CNc1nn2c(n1)[nH]c(c(c2=O)Cc1ccccc1)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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-14-18(12-15-7-4-3-5-8-15)19(27)26-21(23-14)24-20(25-26)22-13-16-9-6-10-17(11-16)28-2/h3-11H,12-13H2,1-2H3,(H2,22,23,24,25)InChIKey
NMZNKIYLVVWLEO-UHFFFAOYSA-NSynonyms
827012-65-76BENZYL2((3METHOXYBENZYL)AMINO)5METHYL(124)TRIAZOLO(15A)PYRIMIDIN7(4H)ONE
6BENZYL2((3METHOXYBENZYL)AMINO)5METHYL(124)TRIAZOLO(15A)PYRIMIDIN7OL
6BENZYL2((3METHOXYPHENYL)METHYLAMINO)5METHYL1H(124)TRIAZOLO(15A)PYRIMIDIN7ONE
827012657
CC1=C(C(=O)N2C(=N1)N=C(N2)NCC3=CC(=CC=C3)OC)CC4=CC=CC=C4
COc1cccc(c1)CNc1nn2c(n1)(nH)c(c(c2=O)Cc1ccccc1)C
InChI=1SC21H21N5O2c11418(12157435815)19(27)2621(2314)2420(2526)221316961017(1116)282h311H1213H212H3(H222232425)
MFCD06002972
ZINC000100281037
ZINC100281037
ZINC18221924
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