Vitas-M small molecule compound

methyl 4-({[3-oxo-1-(phenylsulfonyl)piperazin-2-yl]acetyl}amino)benzoate

Catalog ID
STK938423
SMILES COC(=O)c1ccc(cc1)NC(=O)CC1C(=O)NCCN1S(=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 C20H21N3O6S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6S/c1-29-20(26)14-7-9-15(10-8-14)22-18(24)13-17-19(25)21-11-12-23(17)30(27,28)16-5-3-2-4-6-16/h2-10,17H,11-13H2,1H3,(H,21,25)(H,22,24)
InChIKey
LHBWVFHTACQWRE-UHFFFAOYSA-N
Synonyms
1214831-06-7
1214831067
COC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC=CC=C3
InChI=1SC20H21N3O6Sc12920(26)147915(10814)2218(24)131719(25)21111223(17)30(2728)165324616h21017H1113H21H3(H2125)(H2224)
methyl4(((3oxo1(phenylsulfonyl)piperazin2yl)acetyl)amino)benzoate
methyl4((2(1(benzenesulfonyl)3oxopiperazin2yl)acetyl)amino)benzoate
methyl4(2(3oxo1(phenylsulfonyl)piperazin2yl)acetamido)benzoate
MFCD13758591
ZINC000036359227
ZINC000036359228

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Available files

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