Vitas-M small molecule compound
2-(4-tert-butylbenzyl)-9-[4-(propan-2-yl)phenyl]pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one
Catalog ID
STL126141
SMILES CC(c1ccc(cc1)c1cc2n(n1)ccn1c2nn(c1=O)Cc1ccc(cc1)C(C)(C)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 C27H29N5O MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O/c1-18(2)20-8-10-21(11-9-20)23-16-24-25-29-32(26(33)30(25)14-15-31(24)28-23)17-19-6-12-22(13-7-19)27(3,4)5/h6-16,18H,17H2,1-5H3InChIKey
FKPCFQDEYZVCIZ-UHFFFAOYSA-NSynonyms
2(4tertbutylbenzyl)9(4(propan2yl)phenyl)pyrazolo(15a)(124)triazolo(34c)pyrazin3(2H)one
CC(C)C1=CC=C(C=C1)C2=NN3C=CN4C(=NN(C4=O)CC5=CC=C(C=C5)C(C)(C)C)C3=C2
InChI=1SC27H29N5Oc118(2)2081021(11920)231624252932(26(33)30(25)141531(24)2823)171961222(13719)27(34)5h61618H17H215H3
MFCD20738572
ZINC000067260562
ZINC67260562
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