Vitas-M small molecule compound
3-{[4-(azepan-1-ylcarbonyl)cyclohexyl]methyl}-1,2,3-benzotriazin-4(3H)-one
Catalog ID
STK576820
SMILES O=C(N1CCCCCC1)C1CCC(CC1)Cn1nnc2c(c1=O)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 C21H28N4O2 MW 368.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O2/c26-20(24-13-5-1-2-6-14-24)17-11-9-16(10-12-17)15-25-21(27)18-7-3-4-8-19(18)22-23-25/h3-4,7-8,16-17H,1-2,5-6,9-15H2InChIKey
HZAZDZYZKLESPS-UHFFFAOYSA-NSynonyms
900262-71-73((4(azepan1ylcarbonyl)cyclohexyl)methyl)123benzotriazin4(3H)one
3((4(AZEPANE1CARBONYL)CYCLOHEXYL)METHYL)123BENZOTRIAZIN4ONE
3((4(azepane1carbonyl)cyclohexyl)methyl)benzo(d)(123)triazin4(3H)one
900262717
C1CCCN(CC1)C(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4N=N3
InChI=1SC21H28N4O2c2620(241351261424)1711916(101217)152521(27)18734819(18)222325h34781617H1256915H2
MFCD06772169
ZINC000005206023
ZINC05206023
ZINC5206023
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