Vitas-M small molecule compound
11-(4-propoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK096348
SMILES CCCOc1ccc(cc1)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 C26H26N2O2S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2S/c1-2-13-30-19-11-9-17(10-12-19)26-25-22(27-20-6-3-4-7-21(20)28-26)15-18(16-23(25)29)24-8-5-14-31-24/h3-12,14,18,26-28H,2,13,15-16H2,1H3InChIKey
OMNIURFCWDFEAJ-UHFFFAOYSA-NSynonyms
11(4propoxyphenyl)3(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4propoxyphenyl)9thiophen2yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=CC=CC=C5N2
CCCOc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cccs1
InChI=1SC26H26N2O2Sc1213301911917(101219)262522(2720634721(20)2826)1518(1623(25)29)2485143124h31214182628H2131516H21H3
MFCD03489195
STK096348
ZINC000008430428
ZINC000008430442
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