Vitas-M small molecule compound

ethyl 4-{[4-methyl-3-(phenylsulfamoyl)phenyl]carbonyl}piperazine-1-carboxylate

Catalog ID
STL100970
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(c(c1)S(=O)(=O)Nc1ccccc1)C

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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 C21H25N3O5S MW 431.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O5S/c1-3-29-21(26)24-13-11-23(12-14-24)20(25)17-10-9-16(2)19(15-17)30(27,28)22-18-7-5-4-6-8-18/h4-10,15,22H,3,11-14H2,1-2H3
InChIKey
WQNDIRUMUDOFHT-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)S(=O)(=O)NC3=CC=CC=C3
ethyl4((4methyl3(phenylsulfamoyl)phenyl)carbonyl)piperazine1carboxylate
ETHYL4(3(ANILINOSULFONYL)4METHYLBENZOYL)1PIPERAZINECARBOXYLATE
ETHYL4(4METHYL3(PHENYLSULFAMOYL)BENZOYL)PIPERAZINE1CARBOXYLATE
InChI=1SC21H25N3O5Sc132921(26)24131123(121424)20(25)1710916(2)19(1517)30(2728)22187546818h4101522H31114H212H3
MFCD06001100
ZINC000004001775
ZINC04001775
ZINC4001775

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.