Vitas-M small molecule compound
3-{1-oxo-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Catalog ID
STL318629
SMILES O=C(C(n1nnc2c(c1=O)cccc2)C)N1CCC(CC1)c1nnc2n1cccc2
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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 C21H21N7O2 MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N7O2/c1-14(28-21(30)16-6-2-3-7-17(16)22-25-28)20(29)26-12-9-15(10-13-26)19-24-23-18-8-4-5-11-27(18)19/h2-8,11,14-15H,9-10,12-13H2,1H3InChIKey
BLZOJNUCNUQXJO-UHFFFAOYSA-NSynonyms
(S)3(1(4((124)triazolo(43a)pyridin3yl)piperidin1yl)1oxopropan2yl)benzo(d)(123)triazin4(3H)one
3(1oxo1(4((124)triazolo(43a)pyridin3yl)piperidin1yl)propan2yl)123benzotriazin4(3H)one
3(1oxo1(4((124)triazolo(43a)pyridin3yl)piperidin1yl)propan2yl)123benzotriazin4one
CC(C(=O)N1CCC(CC1)C2=NN=C3N2C=CC=C3)N4C(=O)C5=CC=CC=C5N=N4
InChI=1SC21H21N7O2c114(2821(30)16623717(16)222528)20(29)2612915(101326)192423188451127(18)19h28111415H9101213H21H3
MFCD28031397
O=C((C@@H)(n1nnc2c(c1=O)cccc2)C)N1CCC(CC1)c1nnc2n1cccc2
ZINC000095479457
ZINC000095479458
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