Vitas-M small molecule compound
10-hexanoyl-3-(4-methoxyphenyl)-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL169416
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccc(cc1)OC
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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 C32H33N3O5 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O5/c1-3-4-5-13-30(37)34-28-12-7-6-11-26(28)33-27-19-23(21-14-16-25(40-2)17-15-21)20-29(36)31(27)32(34)22-9-8-10-24(18-22)35(38)39/h6-12,14-18,23,32-33H,3-5,13,19-20H2,1-2H3InChIKey
KDFSJBXMDUSNAH-UHFFFAOYSA-NSynonyms
438476-21-210hexanoyl3(4methoxyphenyl)11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
438476212
5hexanoyl9(4methoxyphenyl)6(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)OC)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)OC
InChI=1SC32H33N3O5c13451330(37)342812761126(28)33271923(21141625(402)171521)2029(36)31(27)32(34)22981024(1822)35(38)39h6121418233233H35131920H212H3
MFCD01922764
ZINC000002100421
ZINC000008398926
Check stock
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Check stock on Vitas-MAvailable files
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