Vitas-M small molecule compound
11-[4-(butan-2-yloxy)phenyl]-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK405139
SMILES CCC(Oc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(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 C25H30N2O2 MW 390.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O2/c1-5-16(2)29-18-12-10-17(11-13-18)24-23-21(14-25(3,4)15-22(23)28)26-19-8-6-7-9-20(19)27-24/h6-13,16,24,26-27H,5,14-15H2,1-4H3InChIKey
BAGZFKRJSDUEGI-UHFFFAOYSA-NSynonyms
11(4(butan2yloxy)phenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4butan2yloxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CCC(C)OC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2
InChI=1SC25H30N2O2c1516(2)2918121017(111318)242321(1425(34)1522(23)28)2619867920(19)2724h61316242627H51415H214H3
MFCD05857828
ZINC000004629395
ZINC000004629399
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