Vitas-M small molecule compound

4-methoxy-N-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}-3-nitrobenzamide

Catalog ID
STK044795
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)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 C20H23N3O6S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O6S/c1-14-9-11-22(12-10-14)30(27,28)17-6-4-16(5-7-17)21-20(24)15-3-8-19(29-2)18(13-15)23(25)26/h3-8,13-14H,9-12H2,1-2H3,(H,21,24)
InChIKey
ZVWDSRZBRHFEKD-UHFFFAOYSA-N
Synonyms
524677-00-7
(4METHOXY3NITROPHENYL)N(4((4METHYLPIPERIDYL)SULFONYL)PHENYL)CARBOXAMIDE
4METHOXYN(4((4METHYLPIPERIDIN1YL)SULFONYL)PHENYL)3NITROBENZAMIDE
4METHOXYN(4(4METHYLPIPERIDIN1YL)SULFONYLPHENYL)3NITROBENZAMIDE
524677007
CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C
InChI=1SC20H23N3O6Sc11491122(121014)30(2728)176416(5717)2120(24)153819(292)18(1315)23(25)26h381314H912H212H3(H2124)
MFCD03616199
STK044795
ZINC000013942854
ZINC13942854

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Available files

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