Vitas-M small molecule compound
(2E)-2-(3,4,5-trimethoxybenzylidene)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-3-one
Catalog ID
STK965829
SMILES COc1c(OC)cc(cc1OC)/C=C\1/N=C2N(C1=O)CCCCC2
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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 C18H22N2O4 MW 330.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O4/c1-22-14-10-12(11-15(23-2)17(14)24-3)9-13-18(21)20-8-6-4-5-7-16(20)19-13/h9-11H,4-8H2,1-3H3/b13-9+InChIKey
YQMMTHKVAUBGEO-UKTHLTGXSA-NSynonyms
325994-39-6(2E)2((345trimethoxyphenyl)methylidene)6789tetrahydro5Himidazo(12a)azepin3one
(2E)2(345trimethoxybenzylidene)256789hexahydro3Himidazo(12a)azepin3one
325994396
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)N3CCCCCC3=N2
COc1c(OC)cc(cc1OC)C=C1N=C2N(C1=O)CCCCC2
InChI=1SC18H22N2O4c122141012(1115(232)17(14)243)91318(21)208645716(20)1913h911H48H213H3b139+
MFCD02251856
ZINC000001409691
ZINC01409691
ZINC1409691
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