Vitas-M small molecule compound
3-[2-amino-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]propyl 3-nitrobenzoate
Catalog ID
STK545792
SMILES O=C(c1cccc(c1)[N+](=O)[O-])OCCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccccc1
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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 C26H21N5O6S MW 531.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N5O6S/c27-24-23(38(35,36)19-10-2-1-3-11-19)22-25(29-21-13-5-4-12-20(21)28-22)30(24)14-7-15-37-26(32)17-8-6-9-18(16-17)31(33)34/h1-6,8-13,16H,7,14-15,27H2InChIKey
QSTOWBWSHPTHJI-UHFFFAOYSA-NSynonyms
750614-47-23(2AMINO3(BENZENESULFONYL)PYRROLO(32B)QUINOXALIN1YL)PROPYL3NITROBENZOATE
3(2amino3(phenylsulfonyl)1Hpyrrolo(23b)quinoxalin1yl)propyl3nitrobenzoate
750614472
C1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCCOC(=O)C5=CC(=CC=C5)(N+)(=O)(O))N
InChI=1SC26H21N5O6Sc272423(38(3536)19102131119)2225(292113541220(21)2822)30(24)147153726(32)1786918(1617)31(33)34h1681316H7141527H2
MFCD03655395
O=C(c1cccc(c1)(N+)(=O)(O))OCCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccccc1
ZINC000002364245
ZINC2364245
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