Vitas-M small molecule compound

1-[4-(methylsulfanyl)benzyl]-4-[(2-nitrophenyl)sulfonyl]piperazine

Catalog ID
STK194471
SMILES CSc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)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 C18H21N3O4S2 MW 407.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O4S2/c1-26-16-8-6-15(7-9-16)14-19-10-12-20(13-11-19)27(24,25)18-5-3-2-4-17(18)21(22)23/h2-9H,10-14H2,1H3
InChIKey
CIDOYXQOABFQRU-UHFFFAOYSA-N
Synonyms

1((4METHYLSULFANYLPHENYL)METHYL)4(2NITROPHENYL)SULFONYLPIPERAZINE
1(4(METHYLSULFANYL)BENZYL)4((2NITROPHENYL)SULFONYL)PIPERAZINE
CSC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3(N+)(=O)(O)
CSc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC18H21N3O4S2c126168615(7916)1419101220(131119)27(2425)18532417(18)21(22)23h29H1014H21H3
MFCD02816228
ZINC000019853557
ZINC19853557

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Available files

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