Vitas-M small molecule compound

10-acetyl-3-(4-tert-butylphenyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK001010
SMILES O=C1CC(CC2=C1C(c1ccco1)N(C(=O)C)c1c(N2)cccc1)c1ccc(cc1)C(C)(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 C29H30N2O3 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O3/c1-18(32)31-24-9-6-5-8-22(24)30-23-16-20(19-11-13-21(14-12-19)29(2,3)4)17-25(33)27(23)28(31)26-10-7-15-34-26/h5-15,20,28,30H,16-17H2,1-4H3
InChIKey
HPSFUBQGMLWZIG-UHFFFAOYSA-N
Synonyms
523992-48-5
10ACETYL3(4(TERTBUTYL)PHENYL)11(2FURYL)1OXO234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPINE
10acetyl3(4(tertbutyl)phenyl)11(furan2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10acetyl3(4tertbutylphenyl)11(furan2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
523992485
5acetyl9(4tertbutylphenyl)6(furan2yl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CC=CO5
InChI=1SC29H30N2O3c118(32)3124965822(24)30231620(19111321(141219)29(23)4)1725(33)27(23)28(31)26107153426h515202830H1617H214H3
MFCD03488957
O=C1CC(CC2=C1C(c1ccco1)N(C(=O)C)c1c(N2)cccc1)c1ccc(cc1)C(C)(C)C
STK001010
ZINC000009312849
ZINC000017196371

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Available files

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