Vitas-M small molecule compound
11-(3-methoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403165
SMILES COc1cccc(c1)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 C24H22N2O2S MW 402.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O2S/c1-28-17-7-4-6-15(12-17)24-23-20(25-18-8-2-3-9-19(18)26-24)13-16(14-21(23)27)22-10-5-11-29-22/h2-12,16,24-26H,13-14H2,1H3InChIKey
BXBHUJZCRSRZJU-UHFFFAOYSA-NSynonyms
11(3methoxyphenyl)3(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3methoxyphenyl)9thiophen2yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=CC=CC=C5N2
InChI=1SC24H22N2O2Sc1281774615(1217)242320(2518823919(18)2624)1316(1421(23)27)22105112922h212162426H1314H21H3
MFCD03146619
ZINC000000781707
ZINC000000781710
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