Vitas-M small molecule compound

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

Catalog ID
STK741916
SMILES CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)c1cccc(c1)[N+](=O)[O-]

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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 C30H29N3O6 MW 527.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O6/c1-4-28(35)32-24-11-6-5-10-22(24)31-23-15-20(18-8-7-9-21(14-18)33(36)37)16-25(34)29(23)30(32)19-12-13-26(38-2)27(17-19)39-3/h5-14,17,20,30-31H,4,15-16H2,1-3H3
InChIKey
CWGLHFVUPUMWRC-UHFFFAOYSA-N
Synonyms
354539-50-7
11(34dimethoxyphenyl)3(3nitrophenyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(34dimethoxyphenyl)3(3nitrophenyl)10propionyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
354539507
6(34dimethoxyphenyl)9(3nitrophenyl)5propanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC(=CC=C3)(N+)(=O)(O))NC4=CC=CC=C41)C5=CC(=C(C=C5)OC)OC
CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC30H29N3O6c1428(35)322411651022(24)31231520(1887921(1418)33(36)37)1625(34)29(23)30(32)19121326(382)27(1719)393h51417203031H41516H213H3
MFCD01952690
ZINC000009318988
ZINC000009318993

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Available files

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