Vitas-M small molecule compound

N-(1H-benzimidazol-2-yl)-1-[3-(propan-2-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide

Catalog ID
STL240917
SMILES O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)C(C)C)Nc1nc2c([nH]1)cccc2

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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 C21H24N8O MW 404.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N8O/c1-13(2)19-26-25-17-7-8-18(27-29(17)19)28-11-9-14(10-12-28)20(30)24-21-22-15-5-3-4-6-16(15)23-21/h3-8,13-14H,9-12H2,1-2H3,(H2,22,23,24,30)
InChIKey
JEMRSESKXLFSEJ-UHFFFAOYSA-N
Synonyms
1040705-08-5
1040705085
CC(C)C1=NN=C2N1N=C(C=C2)N3CCC(CC3)C(=O)NC4=NC5=CC=CC=C5N4
InChI=1SC21H24N8Oc113(2)192625177818(2729(17)19)2811914(101228)20(30)24212215534616(15)2321h381314H912H212H3(H222232430)
MFCD12209257
N(1Hbenzimidazol2yl)1(3(propan2yl)(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
N(1Hbenzimidazol2yl)1(3propan2yl(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
N(1Hbenzo(d)imidazol2yl)1(3isopropyl(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)C(C)C)Nc1nc2c((nH)1)cccc2
ZINC000020738133
ZINC20738133

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Available files

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