Vitas-M small molecule compound
1-benzyl-4-(5-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)piperazine
Catalog ID
STK150196
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)Cc1ccccc1)[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 C28H33N5O4S MW 535.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N5O4S/c1-23-7-10-26(11-8-23)38(36,37)32-19-17-30(18-20-32)25-9-12-27(33(34)35)28(21-25)31-15-13-29(14-16-31)22-24-5-3-2-4-6-24/h2-12,21H,13-20,22H2,1H3InChIKey
QFVOPXHQYGQXRX-UHFFFAOYSA-NSynonyms
1BENZYL4(5(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITROPHENYL)PIPERAZINE
1BENZYL4(5(4(4METHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITROPHENYL)PIPERAZINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCN(CC4)CC5=CC=CC=C5
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC28H33N5O4Sc12371026(11823)38(3637)32191730(182032)2591227(33(34)35)28(2125)31151329(141631)22245324624h21221H132022H21H3
MFCD03017556
ZINC000100134288
ZINC100134288
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