Vitas-M small molecule compound

{3-[4-(2-methoxyphenyl)piperazin-1-yl]quinoxalin-2-yl}[(4-methylphenyl)sulfonyl]acetonitrile

Catalog ID
STK545368
SMILES N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)c1ccccc1OC

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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 C28H27N5O3S MW 513.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O3S/c1-20-11-13-21(14-12-20)37(34,35)26(19-29)27-28(31-23-8-4-3-7-22(23)30-27)33-17-15-32(16-18-33)24-9-5-6-10-25(24)36-2/h3-14,26H,15-18H2,1-2H3
InChIKey
HBXCIKQYXGNLTM-UHFFFAOYSA-N
Synonyms
797774-50-6
(3(4(2methoxyphenyl)piperazin1yl)quinoxalin2yl)((4methylphenyl)sulfonyl)acetonitrile
2(3(4(2METHOXYPHENYL)PIPERAZIN1YL)QUINOXALIN2YL)2(4METHYLPHENYL)SULFONYLACETONITRILE
2(3(4(2methoxyphenyl)piperazin1yl)quinoxalin2yl)2tosylacetonitrile
797774506
CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCN(CC4)C5=CC=CC=C5OC
InChI=1SC28H27N5O3Sc120111321(141220)37(3435)26(1929)2728(3123843722(23)3027)33171532(161833)249561025(24)362h31426H1518H212H3
MFCD03666385
ZINC000009375492
ZINC000009375494

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Available files

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