Vitas-M small molecule compound

methyl 11-(9-ethyl-9H-carbazol-3-yl)-3-methyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate

Catalog ID
STK102695
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(Nc1c(N2)cccc1)c1ccc2c(c1)c1ccccc1n2CC

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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 C30H29N3O3 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3/c1-4-33-24-12-8-5-9-19(24)20-16-18(13-14-25(20)33)28-27-23(31-21-10-6-7-11-22(21)32-28)15-17(2)26(29(27)34)30(35)36-3/h5-14,16-17,26,28,31-32H,4,15H2,1-3H3
InChIKey
YBTJRSSOHJZJLW-UHFFFAOYSA-N
Synonyms

CCN1C2=C(C=C(C=C2)C3C4=C(CC(C(C4=O)C(=O)OC)C)NC5=CC=CC=C5N3)C6=CC=CC=C61
InChI=1SC30H29N3O3c1433241285919(24)201618(131425(20)33)282723(312110671122(21)3228)1517(2)26(29(27)34)30(35)363h514161726283132H415H213H3
methyl11(9ethyl9Hcarbazol3yl)3methyl1oxo23451011hexahydro1Hdibenzo(be)(14)diazepine2carboxylate
METHYL11(9ETHYLCARBAZOL3YL)3METHYL1OXO234TRIHYDRO5H10H11HBENZO(B)BENZO(34F)14DIAZEPINE2CARBOXYLATE
methyl6(9ethylcarbazol3yl)9methyl7oxo56891011hexahydrobenzo(b)(14)benzodiazepine8carboxylate
MFCD03632404
ZINC000009762525
ZINC000102560318

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.