Vitas-M small molecule compound
4-(4-chlorophenyl)-2-{2-nitro-5-[4-(phenylcarbonyl)piperazin-1-yl]phenyl}phthalazin-1(2H)-one
Catalog ID
STK171957
SMILES Clc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=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 C31H24ClN5O4 MW 566.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24ClN5O4/c32-23-12-10-21(11-13-23)29-25-8-4-5-9-26(25)31(39)36(33-29)28-20-24(14-15-27(28)37(40)41)34-16-18-35(19-17-34)30(38)22-6-2-1-3-7-22/h1-15,20H,16-19H2InChIKey
XENNTZHNJZEYNT-UHFFFAOYSA-NSynonyms
2(5(4BENZOYLPIPERAZIN1YL)2NITROPHENYL)4(4CHLOROPHENYL)PHTHALAZIN1ONE
4(4CHLOROPHENYL)2(2NITRO5(4(PHENYLCARBONYL)PIPERAZIN1YL)PHENYL)PHTHALAZIN1(2H)ONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))N3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)Cl)C(=O)C6=CC=CC=C6
Clc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccccc1
InChI=1SC31H24ClN5O4c3223121021(111323)2925845926(25)31(39)36(3329)282024(141527(28)37(40)41)34161835(191734)30(38)226213722h11520H1619H2
MFCD06093802
ZINC000029491432
ZINC29491432
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