Vitas-M small molecule compound

1-[4-(methylsulfanyl)benzyl]-4-(2-nitrobenzyl)piperazine

Catalog ID
STK097484
SMILES CSc1ccc(cc1)CN1CCN(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 C19H23N3O2S MW 357.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O2S/c1-25-18-8-6-16(7-9-18)14-20-10-12-21(13-11-20)15-17-4-2-3-5-19(17)22(23)24/h2-9H,10-15H2,1H3
InChIKey
PBQGEIUWSBTDQG-UHFFFAOYSA-N
Synonyms
462615-84-5
1((4METHYLSULFANYLPHENYL)METHYL)4((2NITROPHENYL)METHYL)PIPERAZINE
1(4(METHYLSULFANYL)BENZYL)4(2NITROBENZYL)PIPERAZINE
462615845
CSC1=CC=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3(N+)(=O)(O)
CSc1ccc(cc1)CN1CCN(CC1)Cc1ccccc1(N+)(=O)(O)
InChI=1SC19H23N3O2Sc125188616(7918)1420101221(131120)1517423519(17)22(23)24h29H1015H21H3
MFCD02825731
STK097484
ZINC000002760495
ZINC2760495

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Available files

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