Vitas-M small molecule compound

ethyl 4-[(4-{[(3,4-dimethylphenyl)(methylsulfonyl)amino]methyl}phenyl)carbonyl]piperazine-1-carboxylate

Catalog ID
STK096195
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)CN(S(=O)(=O)C)c1ccc(c(c1)C)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 C24H31N3O5S MW 473.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O5S/c1-5-32-24(29)26-14-12-25(13-15-26)23(28)21-9-7-20(8-10-21)17-27(33(4,30)31)22-11-6-18(2)19(3)16-22/h6-11,16H,5,12-15,17H2,1-4H3
InChIKey
PMPMMHSGHAMGGU-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)CN(S(=O)(=O)C)c1ccc(c(c1)C)C
CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN(C3=CC(=C(C=C3)C)C)S(=O)(=O)C
ETHYL4((4(((34DIMETHYLPHENYL)(METHYLSULFONYL)AMINO)METHYL)PHENYL)CARBONYL)PIPERAZINE1CARBOXYLATE
ETHYL4(4((34DIMETHYL(METHYLSULFONYL)ANILINO)METHYL)BENZOYL)PIPERAZINE1CARBOXYLATE
ETHYL4(4((34DIMETHYLNMETHYLSULFONYLANILINO)METHYL)BENZOYL)PIPERAZINE1CARBOXYLATE
InChI=1SC24H31N3O5Sc153224(29)26141225(131526)23(28)219720(81021)1727(33(430)31)2211618(2)19(3)1622h61116H5121517H214H3
MFCD02735309
STK096195
ZINC000000656129
ZINC00656129
ZINC656129

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Available files

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