Vitas-M small molecule compound
{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(naphthalen-1-yl)methanone
Catalog ID
STK150361
SMILES O=C(c1cccc2c1cccc2)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)[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 C28H26N4O3 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3/c33-28(25-12-6-10-22-9-4-5-11-24(22)25)31-17-15-30(16-18-31)23-13-14-27(32(34)35)26(19-23)29-20-21-7-2-1-3-8-21/h1-14,19,29H,15-18,20H2InChIKey
QTAFSQLVLYMTPF-UHFFFAOYSA-NSynonyms
(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(NAPHTHALEN1YL)METHANONE
(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)NAPHTHALEN1YLMETHANONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CC=C3)C(=O)C4=CC=CC5=CC=CC=C54
InChI=1SC28H26N4O3c3328(2512610229451124(22)25)31171530(161831)23131427(32(34)35)26(1923)2920217213821h1141929H151820H2
MFCD03306407
O=C(c1cccc2c1cccc2)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)(N+)(=O)(O)
ZINC000009721004
ZINC09721004
ZINC9721004
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