Vitas-M small molecule compound

N-[1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide

Catalog ID
STL040880
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NC(C(=O)Nc1ccc2c(c1)OCO2)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 C23H27N3O6S MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O6S/c1-15-3-6-19(7-4-15)33(29,30)26-11-9-17(10-12-26)23(28)24-16(2)22(27)25-18-5-8-20-21(13-18)32-14-31-20/h3-8,13,16-17H,9-12,14H2,1-2H3,(H,24,28)(H,25,27)
InChIKey
PEEFUIRDRGRJSG-UHFFFAOYSA-N
Synonyms

(S)N(1(benzo(d)(13)dioxol5ylamino)1oxopropan2yl)1tosylpiperidine4carboxamide
CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C(=O)NC3=CC4=C(C=C3)OCO4
Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1ccc2c(c1)OCO2)C
InChI=1SC23H27N3O6Sc1153619(7415)33(2930)2611917(101226)23(28)2416(2)22(27)2518582021(1318)32143120h38131617H91214H212H3(H2428)(H2527)
MFCD18192453
N(1(13benzodioxol5ylamino)1oxopropan2yl)1((4methylphenyl)sulfonyl)piperidine4carboxamide
N(1(13BENZODIOXOL5YLAMINO)1OXOPROPAN2YL)1(4METHYLPHENYL)SULFONYLPIPERIDINE4CARBOXAMIDE
N(2(13BENZODIOXOL5YLAMINO)1METHYL2OXOETHYL)1((4METHYLPHENYL)SULFONYL)PIPERIDINE4CARBOXAMIDE
ZINC000002393658
ZINC000004310167

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Available files

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