Vitas-M small molecule compound

N-(3-methylbutyl)-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide

Catalog ID
STL161097
SMILES CC(CCNC(=O)Cn1nc2CCCCCc2cc1=O)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 C16H25N3O2 MW 291.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25N3O2/c1-12(2)8-9-17-15(20)11-19-16(21)10-13-6-4-3-5-7-14(13)18-19/h10,12H,3-9,11H2,1-2H3,(H,17,20)
InChIKey
LYUKXLJRXUJJLF-UHFFFAOYSA-N
Synonyms
1282127-79-0
1282127790
CC(C)CCNC(=O)CN1C(=O)C=C2CCCCCC2=N1
InChI=1SC16H25N3O2c112(2)891715(20)111916(21)10136435714(13)1819h1012H3911H212H3(H1720)
MFCD18799678
N(3methylbutyl)2(3oxo356789hexahydro2Hcyclohepta(c)pyridazin2yl)acetamide
N(3methylbutyl)2(3oxo6789tetrahydro5Hcyclohepta(c)pyridazin2yl)acetamide
Nisopentyl2(3oxo356789hexahydro2Hcyclohepta(c)pyridazin2yl)acetamide
ZINC000061721303
ZINC61721303

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.