Vitas-M small molecule compound
2-(5-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)-4-phenylphthalazin-1(2H)-one
Catalog ID
STK157778
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(c2ccccc2)c2c(c1=O)cccc2)[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 C31H27N5O5S MW 581.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O5S/c1-22-11-14-25(15-12-22)42(40,41)34-19-17-33(18-20-34)24-13-16-28(36(38)39)29(21-24)35-31(37)27-10-6-5-9-26(27)30(32-35)23-7-3-2-4-8-23/h2-16,21H,17-20H2,1H3InChIKey
SROBARRZCRFKQD-UHFFFAOYSA-NSynonyms
2(2nitro5(4tosylpiperazin1yl)phenyl)4phenylphthalazin1(2H)one
2(5(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITROPHENYL)4PHENYLPHTHALAZIN1(2H)ONE
2(5(4(4METHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITROPHENYL)4PHENYLPHTHALAZIN1ONE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4C(=O)C5=CC=CC=C5C(=N4)C6=CC=CC=C6
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(c2ccccc2)c2c(c1=O)cccc2)(N+)(=O)(O)
InChI=1SC31H27N5O5Sc122111425(151222)42(4041)34191733(182034)24131628(36(38)39)29(2124)3531(37)271065926(27)30(3235)237324823h21621H1720H21H3
MFCD03683960
ZINC000029491449
ZINC29491449
Check stock
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Check stock on Vitas-MAvailable files
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