Vitas-M small molecule compound

3-({4-[(4-nitrophenyl)sulfonyl]piperazin-1-yl}methyl)-1H-indole

Catalog ID
STK081920
SMILES [O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1c[nH]c2c1cccc2

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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 C19H20N4O4S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S/c24-23(25)16-5-7-17(8-6-16)28(26,27)22-11-9-21(10-12-22)14-15-13-20-19-4-2-1-3-18(15)19/h1-8,13,20H,9-12,14H2
InChIKey
BQAWSCRPVSHKFH-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1c(nH)c2c1cccc2
3((4((4NITROPHENYL)SULFONYL)PIPERAZIN1YL)METHYL)1HINDOLE
3((4(4NITROPHENYL)SULFONYLPIPERAZIN1YL)METHYL)1HINDOLE
3(4(4NITROBENZENESULFONYL)PIPERAZIN1YLMETHYL)1HINDOLE
C1CN(CCN1CC2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC19H20N4O4Sc2423(25)165717(8616)28(2627)2211921(101222)1415132019421318(15)19h181320H91214H2
MFCD02816296
STK081920
ZINC000019913960
ZINC19913960

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Available files

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