Vitas-M small molecule compound

1-[(4-methylphenyl)sulfonyl]-4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazine

Catalog ID
STK157496
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)c1ccccc1)[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 C27H31N5O4S MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O4S/c1-22-7-10-25(11-8-22)37(35,36)31-19-17-29(18-20-31)24-9-12-26(32(33)34)27(21-24)30-15-13-28(14-16-30)23-5-3-2-4-6-23/h2-12,21H,13-20H2,1H3
InChIKey
PIALHEIVPTVDCD-UHFFFAOYSA-N
Synonyms

1((4METHYLPHENYL)SULFONYL)4(4NITRO3(4PHENYLPIPERAZIN1YL)PHENYL)PIPERAZINE
1(5(4(4METHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITROPHENYL)4PHENYLPIPERAZINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCN(CC4)C5=CC=CC=C5
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)c1ccccc1)(N+)(=O)(O)
InChI=1SC27H31N5O4Sc12271025(11822)37(3536)31191729(182031)2491226(32(33)34)27(2124)30151328(141630)235324623h21221H1320H21H3
MFCD03614913
ZINC000009720908
ZINC09720908
ZINC9720908

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Available files

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