Vitas-M small molecule compound
2-methoxy-4-[3-(4-methylphenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]phenyl acetate
Catalog ID
STK327101
SMILES COc1cc(ccc1OC(=O)C)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)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 C29H28N2O4 MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O4/c1-17-8-10-19(11-9-17)21-14-24-28(25(33)15-21)29(31-23-7-5-4-6-22(23)30-24)20-12-13-26(35-18(2)32)27(16-20)34-3/h4-13,16,21,29-31H,14-15H2,1-3H3InChIKey
DCCJNLBRFIXPMV-UHFFFAOYSA-NSynonyms
(2methoxy4(9(4methylphenyl)7oxo56891011hexahydrobenzo(b)(14)benzodiazepin6yl)phenyl)acetate
2methoxy4(3(4methylphenyl)1oxo23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)phenylacetate
CC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=C(C=C5)OC(=O)C)OC)C(=O)C2
InChI=1SC29H28N2O4c11781019(11917)21142428(25(33)1521)29(3123754622(23)3024)20121326(3518(2)32)27(1620)343h41316212931H1415H213H3
MFCD03489398
ZINC000001077660
ZINC000001077670
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