Vitas-M small molecule compound
11-(4-hydroxy-3,5-dimethoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403492
SMILES COc1cc(cc(c1O)OC)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 C25H24N2O4S MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4S/c1-30-20-12-15(13-21(31-2)25(20)29)24-23-18(26-16-6-3-4-7-17(16)27-24)10-14(11-19(23)28)22-8-5-9-32-22/h3-9,12-14,24,26-27,29H,10-11H2,1-2H3InChIKey
GNKHAOYTTTZSRO-UHFFFAOYSA-NSynonyms
11(4hydroxy35dimethoxyphenyl)3(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4hydroxy35dimethoxyphenyl)9thiophen2yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1O)OC)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=CC=CC=C5N2
InChI=1SC25H24N2O4Sc130201215(1321(312)25(20)29)242318(2616634717(16)2724)1014(1119(23)28)228593222h39121424262729H1011H212H3
MFCD03489343
ZINC000000729453
ZINC000000729456
Check stock
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Check stock on Vitas-MAvailable files
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