Vitas-M small molecule compound

3,3-dimethyl-11-(3-nitrophenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK007413
SMILES CCC(=O)N1C(c2cccc(c2)[N+](=O)[O-])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 C24H25N3O4 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4/c1-4-21(29)26-19-11-6-5-10-17(19)25-18-13-24(2,3)14-20(28)22(18)23(26)15-8-7-9-16(12-15)27(30)31/h5-12,23,25H,4,13-14H2,1-3H3
InChIKey
ARGQGLBWBZQVBB-UHFFFAOYSA-N
Synonyms
312621-36-6
312621366
33dimethyl11(3nitrophenyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl11(3nitrophenyl)10propionyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl6(3nitrophenyl)5propanoyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=CC=C4)(N+)(=O)(O)
CCC(=O)N1C(c2cccc(c2)(N+)(=O)(O))C2=C(Nc3c1cccc3)CC(CC2=O)(C)C
InChI=1SC24H25N3O4c1421(29)261911651017(19)25181324(23)1420(28)22(18)23(26)1587916(1215)27(30)31h5122325H41314H213H3
MFCD01466060
STK007413
ZINC000009329643
ZINC000016956671

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Available files

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