Vitas-M small molecule compound
methyl 4-[3-(4-fluorophenyl)-1-oxo-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Catalog ID
STK775985
SMILES COC(=O)c1ccc(cc1)C1C2=C(Nc3c(N1C(=O)c1ccccc1)cccc3)CC(CC2=O)c1ccc(cc1)F
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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 C34H27FN2O4 MW 546.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27FN2O4/c1-41-34(40)24-13-11-22(12-14-24)32-31-28(19-25(20-30(31)38)21-15-17-26(35)18-16-21)36-27-9-5-6-10-29(27)37(32)33(39)23-7-3-2-4-8-23/h2-18,25,32,36H,19-20H2,1H3InChIKey
SXKFJWGUZMQKMG-UHFFFAOYSA-NSynonyms
488842-28-0488842280
COC(=O)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)F)NC5=CC=CC=C5N2C(=O)C6=CC=CC=C6
InChI=1SC34H27FN2O4c14134(40)24131122(121424)323128(1925(2030(31)38)21151726(35)181621)36279561029(27)37(32)33(39)237324823h218253236H1920H21H3
methyl4(10benzoyl3(4fluorophenyl)1oxo23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)benzoate
methyl4(3(4fluorophenyl)1oxo10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)benzoate
methyl4(5benzoyl9(4fluorophenyl)7oxo891011tetrahydro6Hbenzo(b)(14)benzodiazepin6yl)benzoate
MFCD03294396
ZINC000049918055
ZINC000049918058
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