Vitas-M small molecule compound
1-[11-(3,4-dimethoxyphenyl)-1-hydroxy-3-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]hexan-1-one
Catalog ID
STL044456
SMILES CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cccc(c2)[N+](=O)[O-])C1c1ccc(c(c1)OC)OC
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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 C33H35N3O6 MW 569.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O6/c1-4-5-6-14-31(38)35-27-13-8-7-12-25(27)34-26-18-23(21-10-9-11-24(17-21)36(39)40)19-28(37)32(26)33(35)22-15-16-29(41-2)30(20-22)42-3/h7-13,15-17,20,23,33,37H,4-6,14,18-19H2,1-3H3InChIKey
DSCIVNJGQHNIGS-UHFFFAOYSA-NSynonyms
1(11(34dimethoxyphenyl)1hydroxy3(3nitrophenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cccc(c2)(N+)(=O)(O))C1c1ccc(c(c1)OC)OC
MFCD03804983
ZINC000102875235
ZINC000102875248
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