Vitas-M small molecule compound
3-[(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Catalog ID
STK578132
SMILES O=C([C@@H](n1nnc2c(c1=O)cccc2)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 C16H20N4O2 MW 300.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2/c1-12(15(21)19-10-6-2-3-7-11-19)20-16(22)13-8-4-5-9-14(13)17-18-20/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3/t12-/m0/s1InChIKey
FKMOOKSGQMENOZ-LBPRGKRZSA-NSynonyms
1173680-55-1(S)3(1(azepan1yl)1oxopropan2yl)benzo(d)(123)triazin4(3H)one
1173680551
3((2S)1(azepan1yl)1oxopropan2yl)123benzotriazin4(3H)one
3((2S)1(azepan1yl)1oxopropan2yl)123benzotriazin4one
CC(C(=O)N1CCCCCC1)N2C(=O)C3=CC=CC=C3N=N2
InChI=1SC16H20N4O2c112(15(21)191062371119)2016(22)13845914(13)171820h458912H23671011H21H3t12m0s1
MFCD06779524
O=C((C@@H)(n1nnc2c(c1=O)cccc2)C)N1CCCCCC1
ZINC000005306087
ZINC05306087
ZINC5306087
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