Vitas-M small molecule compound

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

Catalog ID
STK149829
SMILES COc1cccc(c1)C1C2=C(CC(CC2=O)c2ccc(cc2)C)Nc2c(N1C(=O)CC(C)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 C32H34N2O3 MW 494.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O3/c1-20(2)16-30(36)34-28-11-6-5-10-26(28)33-27-18-24(22-14-12-21(3)13-15-22)19-29(35)31(27)32(34)23-8-7-9-25(17-23)37-4/h5-15,17,20,24,32-33H,16,18-19H2,1-4H3
InChIKey
GHHAOZBZPUPKGM-UHFFFAOYSA-N
Synonyms

11(3methoxyphenyl)10(3methylbutanoyl)3(4methylphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(3METHOXYPHENYL)10(3METHYLBUTANOYL)3(4METHYLPHENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
6(3methoxyphenyl)5(3methylbutanoyl)9(4methylphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)CC(C)C)C5=CC(=CC=C5)OC)C(=O)C2
InChI=1SC32H34N2O3c120(2)1630(36)342811651026(28)33271824(22141221(3)131522)1929(35)31(27)32(34)2387925(1723)374h5151720243233H161819H214H3
MFCD03759976
ZINC000001459004
ZINC000001459007

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Available files

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