Vitas-M small molecule compound
2-(4-oxo-4,6,7,8,9,10-hexahydropyrimido[1,2-a]azepin-2-yl)phenyl acetate
Catalog ID
STL229225
SMILES CC(=O)Oc1ccccc1c1nc2CCCCCn2c(=O)c1
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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 C17H18N2O3 MW 298.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O3/c1-12(20)22-15-8-5-4-7-13(15)14-11-17(21)19-10-6-2-3-9-16(19)18-14/h4-5,7-8,11H,2-3,6,9-10H2,1H3InChIKey
ADWMERQWUDATAE-UHFFFAOYSA-NSynonyms
(2(4oxo78910tetrahydro6Hpyrimido(12a)azepin2yl)phenyl)acetate
2(4oxo4678910hexahydropyrimido(12a)azepin2yl)phenylacetate
CC(=O)OC1=CC=CC=C1C2=CC(=O)N3CCCCCC3=N2
InChI=1SC17H18N2O3c112(20)2215854713(15)141117(21)1910623916(19)1814h457811H236910H21H3
MFCD06736047
ZINC000006857100
ZINC06857100
ZINC6857100
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