Vitas-M small molecule compound

3-(4-tert-butylphenyl)-10-[(2-chlorophenyl)carbonyl]-11-(4-fluorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK545905
SMILES Fc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)C(C)(C)C)Nc2c(N1C(=O)c1ccccc1Cl)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 C36H32ClFN2O2 MW 579.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H32ClFN2O2/c1-36(2,3)25-16-12-22(13-17-25)24-20-30-33(32(41)21-24)34(23-14-18-26(38)19-15-23)40(31-11-7-6-10-29(31)39-30)35(42)27-8-4-5-9-28(27)37/h4-19,24,34,39H,20-21H2,1-3H3
InChIKey
HIDBFCAYHFMHLE-UHFFFAOYSA-N
Synonyms

3(4(tertbutyl)phenyl)10(2chlorobenzoyl)11(4fluorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4tertbutylphenyl)10((2chlorophenyl)carbonyl)11(4fluorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)5(2chlorobenzoyl)6(4fluorophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(C)(C)C1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC=CC=C5Cl)C6=CC=C(C=C6)F)C(=O)C2
InChI=1SC36H32ClFN2O2c136(23)25161222(131725)24203033(32(41)2124)34(23141826(38)191523)40(3111761029(31)3930)35(42)27845928(27)37h419243439H2021H213H3
MFCD03296988
ZINC000049771674
ZINC000049771677

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Available files

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