Vitas-M small molecule compound
11-(3-bromo-4-methylphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK407139
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1ccc(c(c1)Br)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 C22H23BrN2O MW 411.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O/c1-13-8-9-14(10-15(13)23)21-20-18(11-22(2,3)12-19(20)26)24-16-6-4-5-7-17(16)25-21/h4-10,21,24-25H,11-12H2,1-3H3InChIKey
QCOGIDUTDDORPW-UHFFFAOYSA-NSynonyms
704873-45-011(3bromo4methylphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3bromo4methylphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
704873450
CC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2)Br
InChI=1SC22H23BrN2Oc1138914(1015(13)23)212018(1122(23)1219(20)26)2416645717(16)2521h410212425H1112H213H3
MFCD05857833
ZINC000001428682
ZINC000001428683
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