Vitas-M small molecule compound
4-methyl-2-{2-nitro-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}phthalazin-1(2H)-one
Catalog ID
STK154793
SMILES [O-][N+](=O)c1ccc(cc1n1nc(C)c2c(c1=O)cccc2)N1CCN(CC1)C(=O)c1cccs1
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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 C24H21N5O4S MW 475.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O4S/c1-16-18-5-2-3-6-19(18)23(30)28(25-16)21-15-17(8-9-20(21)29(32)33)26-10-12-27(13-11-26)24(31)22-7-4-14-34-22/h2-9,14-15H,10-13H2,1H3InChIKey
QQAYFISXVYXHCJ-UHFFFAOYSA-NSynonyms
597545-73-8(O)(N+)(=O)c1ccc(cc1n1nc(C)c2c(c1=O)cccc2)N1CCN(CC1)C(=O)c1cccs1
4METHYL2(2NITRO5(4(THIOPHEN2YLCARBONYL)PIPERAZIN1YL)PHENYL)PHTHALAZIN1(2H)ONE
4methyl2(2nitro5(4(thiophene2carbonyl)piperazin1yl)phenyl)phthalazin1(2H)one
4METHYL2(2NITRO5(4(THIOPHENE2CARBONYL)PIPERAZIN1YL)PHENYL)PHTHALAZIN1ONE
597545738
CC1=NN(C(=O)C2=CC=CC=C12)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC=CS5)(N+)(=O)(O)
InChI=1SC24H21N5O4Sc11618523619(18)23(30)28(2516)211517(8920(21)29(32)33)26101227(131126)24(31)2274143422h291415H1013H21H3
MFCD03923679
ZINC000009313286
ZINC09313286
ZINC9313286
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