Vitas-M small molecule compound
11-(3-ethoxy-4-methoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403412
SMILES CCOc1cc(ccc1OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cccs1
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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 C26H26N2O3S MW 446.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O3S/c1-3-31-23-15-16(10-11-22(23)30-2)26-25-20(27-18-7-4-5-8-19(18)28-26)13-17(14-21(25)29)24-9-6-12-32-24/h4-12,15,17,26-28H,3,13-14H2,1-2H3InChIKey
UYDAAXFSHMLTJY-UHFFFAOYSA-NSynonyms
11(3ethoxy4methoxyphenyl)3(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3ethoxy4methoxyphenyl)9thiophen2yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=CC=CC=C5N2)OC
InChI=1SC26H26N2O3Sc1331231516(101122(23)302)262520(2718745819(18)2826)1317(1421(25)29)2496123224h41215172628H31314H212H3
MFCD03489240
ZINC000006089734
ZINC000006089739
Check stock
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Check stock on Vitas-MAvailable files
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