Vitas-M small molecule compound
azepan-1-yl[3,4-dimethyl-2-(1H-tetrazol-1-yl)phenyl]methanone
Catalog ID
STK941093
SMILES O=C(c1ccc(c(c1n1cnnn1)C)C)N1CCCCCC1
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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 C16H21N5O MW 299.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O/c1-12-7-8-14(15(13(12)2)21-11-17-18-19-21)16(22)20-9-5-3-4-6-10-20/h7-8,11H,3-6,9-10H2,1-2H3InChIKey
NBVXVLSVNYPCFN-UHFFFAOYSA-NSynonyms
1224129-05-81224129058
azepan1yl(34dimethyl2(1Htetrazol1yl)phenyl)methanone
azepan1yl(34dimethyl2(tetrazol1yl)phenyl)methanone
CC1=C(C(=C(C=C1)C(=O)N2CCCCCC2)N3C=NN=N3)C
InChI=1SC16H21N5Oc1127814(15(13(12)2)211117181921)16(22)20953461020h7811H36910H212H3
MFCD18069285
ZINC000044919886
ZINC44919886
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