Vitas-M small molecule compound
11-(1,3-benzodioxol-5-yl)-3,3-dimethyl-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK040268
SMILES CC(C(=O)N1C(c2ccc3c(c2)OCO3)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C)C
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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 C26H28N2O4 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O4/c1-15(2)25(30)28-19-8-6-5-7-17(19)27-18-12-26(3,4)13-20(29)23(18)24(28)16-9-10-21-22(11-16)32-14-31-21/h5-11,15,24,27H,12-14H2,1-4H3InChIKey
BYIRBTICBVTIIR-UHFFFAOYSA-NSynonyms
312621-51-511(13benzodioxol5yl)33dimethyl10(2methylpropanoyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(benzo(d)(13)dioxol5yl)10isobutyryl33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312621515
6(13benzodioxol5yl)99dimethyl5(2methylpropanoyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC(C(=O)N1C(c2ccc3c(c2)OCO3)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C)C
CC(C)C(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC5=C(C=C4)OCO5
InChI=1SC26H28N2O4c115(2)25(30)2819865717(19)27181226(34)1320(29)23(18)24(28)169102122(1116)32143121h511152427H1214H214H3
MFCD01811049
STK040268
ZINC000000854103
ZINC000000854104
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