Vitas-M small molecule compound

1H-indol-3-yl[4-(phenylsulfonyl)piperazin-1-yl]acetic acid

Catalog ID
STK636256
SMILES OC(=O)C(c1c[nH]c2c1cccc2)N1CCN(CC1)S(=O)(=O)c1ccccc1

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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 C20H21N3O4S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S/c24-20(25)19(17-14-21-18-9-5-4-8-16(17)18)22-10-12-23(13-11-22)28(26,27)15-6-2-1-3-7-15/h1-9,14,19,21H,10-13H2,(H,24,25)
InChIKey
AINPSUVYTAETRI-UHFFFAOYSA-N
Synonyms
1010915-40-8
1010915408
1Hindol3yl(4(phenylsulfonyl)piperazin1yl)aceticacid
2(1Hindol3yl)2(4(phenylsulfonyl)piperazin1yl)aceticacid
2(4(benzenesulfonyl)piperazin1yl)2(1Hindol3yl)aceticacid
C1CN(CCN1C(C2=CNC3=CC=CC=C32)C(=O)O)S(=O)(=O)C4=CC=CC=C4
InChI=1SC20H21N3O4Sc2420(25)19(17142118954816(17)18)22101223(131122)28(2627)156213715h19141921H1013H2(H2425)
MFCD12199149
OC(=O)C(c1c(nH)c2c1cccc2)N1CCN(CC1)S(=O)(=O)c1ccccc1
ZINC000012321293
ZINC000012321294

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Available files

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