Vitas-M small molecule compound

1-[3-(4-tert-butylphenyl)-1-hydroxy-11-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-methylpropan-1-one

Catalog ID
STL042638
SMILES CC(C(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C(C)(C)C)C1c1cccc(c1)[N+](=O)[O-])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 C33H35N3O4 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O4/c1-20(2)32(38)35-28-12-7-6-11-26(28)34-27-18-23(21-13-15-24(16-14-21)33(3,4)5)19-29(37)30(27)31(35)22-9-8-10-25(17-22)36(39)40/h6-17,20,23,31,37H,18-19H2,1-5H3
InChIKey
DDISXWZZZYTVPI-UHFFFAOYSA-N
Synonyms

1(3(4tertbutylphenyl)1hydroxy11(3nitrophenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2methylpropan1one
CC(C(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C(C)(C)C)C1c1cccc(c1)(N+)(=O)(O))C
MFCD05728286
ZINC000101648368
ZINC000101648377

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Available files

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