Vitas-M small molecule compound
2-[11-(furan-2-yl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-(4-methoxybenzyl)acetamide
Catalog ID
STK262830
SMILES COc1ccc(cc1)CNC(=O)CN1c2ccccc2NC2=C(C1c1ccco1)C(=O)CC(C2)(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 C29H31N3O4 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4/c1-29(2)15-22-27(24(33)16-29)28(25-9-6-14-36-25)32(23-8-5-4-7-21(23)31-22)18-26(34)30-17-19-10-12-20(35-3)13-11-19/h4-14,28,31H,15-18H2,1-3H3,(H,30,34)InChIKey
WRDRWIGWSHSIMM-UHFFFAOYSA-NSynonyms
2(11(2FURYL)33DIMETHYL1OXO(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))N((4METHOXYPHENYL)METHYL)ACETAMIDE
2(11(furan2yl)33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)N(4methoxybenzyl)acetamide
2(6(furan2yl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepin5yl)N((4methoxyphenyl)methyl)acetamide
CC1(CC2=C(C(N(C3=CC=CC=C3N2)CC(=O)NCC4=CC=C(C=C4)OC)C5=CC=CO5)C(=O)C1)C
InChI=1SC29H31N3O4c129(2)152227(24(33)1629)28(2596143625)32(23854721(23)3122)1826(34)301719101220(353)131119h4142831H1518H213H3(H3034)
MFCD08548339
ZINC000009483329
ZINC000009483333
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