Vitas-M small molecule compound

1-(4-methylbenzyl)-4-[(3-nitrophenyl)sulfonyl]piperazine

Catalog ID
STK469295
SMILES Cc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)c1cccc(c1)[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 C18H21N3O4S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O4S/c1-15-5-7-16(8-6-15)14-19-9-11-20(12-10-19)26(24,25)18-4-2-3-17(13-18)21(22)23/h2-8,13H,9-12,14H2,1H3
InChIKey
VGMUALBPUOKLMR-UHFFFAOYSA-N
Synonyms

1((4((4METHYLPHENYL)METHYL)PIPERAZINYL)SULFONYL)3NITROBENZENE
1((4METHYLPHENYL)METHYL)4(3NITROPHENYL)SULFONYLPIPERAZINE
1(4methylbenzyl)4((3nitrophenyl)sulfonyl)piperazine
CC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)(N+)(=O)(O)
Cc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC18H21N3O4Sc1155716(8615)141991120(121019)26(2425)1842317(1318)21(22)23h2813H91214H21H3
MFCD06062439
ZINC000020367283
ZINC20367283

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Available files

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