Vitas-M small molecule compound

N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-3-(phenylsulfonyl)propanamide

Catalog ID
STK221149
SMILES O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)CCS(=O)(=O)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 C17H16N2O5S3 MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S3/c1-26(21,22)13-7-8-14-15(11-13)25-17(18-14)19-16(20)9-10-27(23,24)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H,18,19,20)
InChIKey
RPYBGVAFQKGJLP-UHFFFAOYSA-N
Synonyms
868676-31-7
3(BENZENESULFONYL)N(6METHYLSULFONYL13BENZOTHIAZOL2YL)PROPANAMIDE
3BENZENESULFONYLN(6METHANESULFONYLBENZOTHIAZOL2YL)PROPIONAMIDE
868676317
CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3
InChI=1SC17H16N2O5S3c126(2122)13781415(1113)2517(1814)1916(20)91027(2324)125324612h2811H910H21H3(H181920)
MFCD05923572
N(6(methylsulfonyl)13benzothiazol2yl)3(phenylsulfonyl)propanamide
N(6(METHYLSULFONYL)BENZO(D)THIAZOL2YL)3(PHENYLSULFONYL)PROPANAMIDE
N(6(METHYLSULFONYL)BENZOTHIAZOL2YL)3(PHENYLSULFONYL)PROPANAMIDE
ZINC000009599555
ZINC09599555
ZINC9599555

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Available files

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