Vitas-M small molecule compound
2-{5-[4-(naphthalen-2-ylsulfonyl)piperazin-1-yl]-2-nitrophenyl}-1,2,3,4-tetrahydroisoquinoline
Catalog ID
STK050000
SMILES [O-][N+](=O)c1ccc(cc1N1CCc2c(C1)cccc2)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)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 C29H28N4O4S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O4S/c34-33(35)28-12-10-26(20-29(28)31-14-13-23-6-2-4-8-25(23)21-31)30-15-17-32(18-16-30)38(36,37)27-11-9-22-5-1-3-7-24(22)19-27/h1-12,19-20H,13-18,21H2InChIKey
XKYYJCOHSQLWLD-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1N1CCc2c(C1)cccc2)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2
2(5(4(naphthalen2ylsulfonyl)piperazin1yl)2nitrophenyl)1234tetrahydroisoquinoline
2(5(4NAPHTHALEN2YLSULFONYLPIPERAZIN1YL)2NITROPHENYL)34DIHYDRO1HISOQUINOLINE
C1CN(CC2=CC=CC=C21)C3=C(C=CC(=C3)N4CCN(CC4)S(=O)(=O)C5=CC6=CC=CC=C6C=C5)(N+)(=O)(O)
InChI=1SC29H28N4O4Sc3433(35)28121026(2029(28)31141323624825(23)2131)30151732(181630)38(3637)2711922513724(22)1927h1121920H131821H2
MFCD03228105
STK050000
ZINC000100140426
ZINC100140426
Check stock
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