Vitas-M small molecule compound
11-(4-oxo-4H-chromen-2-yl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK701231
SMILES O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1cc(=O)c2c(o1)cccc2)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 C26H20N2O3S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O3S/c29-20-14-23(31-22-9-4-1-6-16(20)22)26-25-19(27-17-7-2-3-8-18(17)28-26)12-15(13-21(25)30)24-10-5-11-32-24/h1-11,14-15,26-28H,12-13H2InChIKey
KBXAJVANAVAWLX-UHFFFAOYSA-NSynonyms
11(4oxo4Hchromen2yl)3(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4oxochromen2yl)9thiophen2yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC(=O)C5=CC=CC=C5O4)C6=CC=CS6
InChI=1SC26H20N2O3Sc29201423(3122941616(20)22)262519(2717723818(17)2826)1215(1321(25)30)24105113224h11114152628H1213H2
MFCD03371062
ZINC000000711581
ZINC000000711586
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