Vitas-M small molecule compound
1-(2,4-dimethylbenzyl)-3,3-dimethyl-4-[(4-nitrophenyl)carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Catalog ID
STK874339
SMILES Cc1ccc(c(c1)C)CN1c2ccccc2N(C(C1=O)(C)C)C(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C26H25N3O4 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4/c1-17-9-10-20(18(2)15-17)16-27-22-7-5-6-8-23(22)28(26(3,4)25(27)31)24(30)19-11-13-21(14-12-19)29(32)33/h5-15H,16H2,1-4H3InChIKey
KRASLOJPGAZSNB-UHFFFAOYSA-NSynonyms
1((24DIMETHYLPHENYL)METHYL)33DIMETHYL4(4NITROBENZOYL)QUINOXALIN2ONE
1(24dimethylbenzyl)33dimethyl4((4nitrophenyl)carbonyl)34dihydroquinoxalin2(1H)one
1(24DIMETHYLBENZYL)33DIMETHYL4(4NITROBENZOYL)34DIHYDROQUINOXALIN2(1H)ONE
CC1=CC(=C(C=C1)CN2C3=CC=CC=C3N(C(C2=O)(C)C)C(=O)C4=CC=C(C=C4)(N+)(=O)(O))C
Cc1ccc(c(c1)C)CN1c2ccccc2N(C(C1=O)(C)C)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H25N3O4c11791020(18(2)1517)162722756823(22)28(26(34)25(27)31)24(30)19111321(141219)29(32)33h515H16H214H3
MFCD02214456
ZINC000009333797
ZINC09333797
ZINC9333797
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