Vitas-M small molecule compound

10-acetyl-11-(4-methylphenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK868403
SMILES Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccccc2)Nc2c(N1C(=O)C)cccc2

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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 C28H26N2O2 MW 422.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O2/c1-18-12-14-21(15-13-18)28-27-24(16-22(17-26(27)32)20-8-4-3-5-9-20)29-23-10-6-7-11-25(23)30(28)19(2)31/h3-15,22,28-29H,16-17H2,1-2H3
InChIKey
NRLLPGQHADAYFB-UHFFFAOYSA-N
Synonyms

10ACETYL11(4METHYLPHENYL)1OXO3PHENYL234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPINE
10acetyl11(4methylphenyl)3phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10acetyl3phenyl11(ptolyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5acetyl6(4methylphenyl)9phenyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=CC=CC=C5N2C(=O)C
InChI=1SC28H26N2O2c118121421(151318)282724(1622(1726(27)32)208435920)292310671125(23)30(28)19(2)31h315222829H1617H212H3
MFCD01957531
ZINC000000685699
ZINC000000685702

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Available files

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