Vitas-M small molecule compound

4-[11-(4-tert-butylphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid

Catalog ID
STK149711
SMILES OC(=O)CCC(=O)N1C(c2ccc(cc2)C(C)(C)C)C2=C(Nc3c1cccc3)CC(CC2=O)(C)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 C29H34N2O4 MW 474.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O4/c1-28(2,3)19-12-10-18(11-13-19)27-26-21(16-29(4,5)17-23(26)32)30-20-8-6-7-9-22(20)31(27)24(33)14-15-25(34)35/h6-13,27,30H,14-17H2,1-5H3,(H,34,35)
InChIKey
OZRYRMPNFHITFC-UHFFFAOYSA-N
Synonyms
578758-53-9
4(11(4(TERTBUTYL)PHENYL)33DIMETHYL1OXO(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))4OXOBUTANOICACID
4(11(4(tertbutyl)phenyl)33dimethyl1oxo34dihydro1Hdibenzo(be)(14)diazepin10(2H5H11H)yl)4oxobutanoicacid
4(11(4tertbutylphenyl)33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
4(6(4tertbutylphenyl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepin5yl)4oxobutanoicacid
578758539
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)CCC(=O)O)C4=CC=C(C=C4)C(C)(C)C)C(=O)C1)C
InChI=1SC29H34N2O4c128(23)19121018(111319)272621(1629(45)1723(26)32)3020867922(20)31(27)24(33)141525(34)35h6132730H1417H215H3(H3435)
MFCD03613027
ZINC000009424600
ZINC000009424601

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Available files

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