Vitas-M small molecule compound
3-bromo-10-(4-methoxyphenyl)-7,7-dimethyl-5,6,7,8,10,11-hexahydro-9H-pyrido[3,2-b][1,4]benzodiazepin-9-one
Catalog ID
STK262419
SMILES COc1ccc(cc1)C1Nc2ncc(cc2NC2=C1C(=O)CC(C2)(C)C)Br
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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 C21H22BrN3O2 MW 428.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O2/c1-21(2)9-16-18(17(26)10-21)19(12-4-6-14(27-3)7-5-12)25-20-15(24-16)8-13(22)11-23-20/h4-8,11,19,24H,9-10H2,1-3H3,(H,23,25)InChIKey
RVGOTZRJQBHRCH-UHFFFAOYSA-NSynonyms
2bromo6(4methoxyphenyl)99dimethyl681011tetrahydro5Hpyrido(32b)(14)benzodiazepin7one
3bromo10(4methoxyphenyl)77dimethyl56781011hexahydro9Hpyrido(32b)(14)benzodiazepin9one
3BROMO10(4METHOXYPHENYL)77DIMETHYL678TRIHYDRO5H10H11HBENZO(21F)PYRIDINO(32B)14DIAZEPIN9ONE
CC1(CC2=C(C(NC3=NC=C(C=C3N2)Br)C4=CC=C(C=C4)OC)C(=O)C1)C
InChI=1SC21H22BrN3O2c121(2)91618(17(26)1021)19(124614(273)7512)252015(2416)813(22)112320h48111924H910H213H3(H2325)
MFCD08547726
ZINC000018244360
ZINC000018244361
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