Vitas-M small molecule compound

ethyl 4-{N-[(4-chlorophenyl)sulfonyl]-N-cyclohexylglycyl}piperazine-1-carboxylate

Catalog ID
STK047774
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccc(cc1)Cl)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 C21H30ClN3O5S MW 472.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30ClN3O5S/c1-2-30-21(27)24-14-12-23(13-15-24)20(26)16-25(18-6-4-3-5-7-18)31(28,29)19-10-8-17(22)9-11-19/h8-11,18H,2-7,12-16H2,1H3
InChIKey
NCKCTYVUAHLNCV-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl
CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccc(cc1)Cl)C1CCCCC1
ETHYL4(2((4CHLOROPHENYL)SULFONYLCYCLOHEXYLAMINO)ACETYL)PIPERAZINE1CARBOXYLATE
ETHYL4(N((4CHLOROPHENYL)SULFONYL)NCYCLOHEXYLGLYCYL)1PIPERAZINECARBOXYLATE
ETHYL4(N((4CHLOROPHENYL)SULFONYL)NCYCLOHEXYLGLYCYL)PIPERAZINE1CARBOXYLATE
InChI=1SC21H30ClN3O5Sc123021(27)24141223(131524)20(26)1625(186435718)31(2829)1910817(22)91119h81118H271216H21H3
MFCD03711683
STK047774
ZINC000008670749
ZINC08670749
ZINC8670749

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Available files

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