Vitas-M small molecule compound
4-[3-(4-fluorophenyl)-1-oxo-10-(thiophen-2-ylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzonitrile
Catalog ID
STK149765
SMILES N#Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)F)Nc2c(N1C(=O)c1cccs1)cccc2
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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 C31H22FN3O2S MW 519.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22FN3O2S/c32-23-13-11-20(12-14-23)22-16-25-29(27(36)17-22)30(21-9-7-19(18-33)8-10-21)35(31(37)28-6-3-15-38-28)26-5-2-1-4-24(26)34-25/h1-15,22,30,34H,16-17H2InChIKey
SNIBPKOEDAGUPW-UHFFFAOYSA-NSynonyms
634174-81-54(3(4FLUOROPHENYL)1OXO10(2THIENYLCARBONYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN11YL)BENZENECARBONITRILE
4(3(4fluorophenyl)1oxo10(thiophen2ylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)benzonitrile
4(3(4fluorophenyl)1oxo10(thiophene2carbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)benzonitrile
4(9(4fluorophenyl)7oxo5(thiophene2carbonyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin6yl)benzonitrile
634174815
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CC=C(C=C4)C#N)C(=O)C5=CC=CS5)C6=CC=C(C=C6)F
InChI=1SC31H22FN3O2Sc3223131120(121423)22162529(27(36)1722)30(219719(1833)81021)35(31(37)2863153828)26521424(26)3425h115223034H1617H2
MFCD03613102
ZINC000018254431
ZINC000018254436
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