Vitas-M small molecule compound
3-(4-tert-butylphenyl)-10-hexanoyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK078141
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccc(cc1)C(C)(C)C
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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 C35H39N3O4 MW 565.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H39N3O4/c1-5-6-7-15-32(40)37-30-14-9-8-13-28(30)36-29-21-25(23-16-18-26(19-17-23)35(2,3)4)22-31(39)33(29)34(37)24-11-10-12-27(20-24)38(41)42/h8-14,16-20,25,34,36H,5-7,15,21-22H2,1-4H3InChIKey
YLURVBPDUSIJMS-UHFFFAOYSA-NSynonyms
3(4(tertbutyl)phenyl)10hexanoyl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4tertbutylphenyl)10hexanoyl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)5hexanoyl6(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CC(=CC=C5)(N+)(=O)(O)
CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CC(C2)c1ccc(cc1)C(C)(C)C
InChI=1SC35H39N3O4c15671532(40)373014981328(30)36292125(23161826(191723)35(23)4)2231(39)33(29)34(37)2411101227(2024)38(41)42h8141620253436H57152122H214H3
MFCD03488955
STK078141
ZINC000053319435
ZINC000053319438
Check stock
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Check stock on Vitas-MAvailable files
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