Vitas-M small molecule compound
N-[4,5-dimethyl-3-(phenylsulfonyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]-4-nitrobenzamide
Catalog ID
STL303631
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1n(C(C)C)c(c(c1S(=O)(=O)c1ccccc1)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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-14(2)24-16(4)15(3)20(31(29,30)19-8-6-5-7-9-19)21(24)23-22(26)17-10-12-18(13-11-17)25(27)28/h5-14H,1-4H3,(H,23,26)InChIKey
UXNKAXYQZJHPKX-UHFFFAOYSA-NSynonyms
1010885-40-11010885401
CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C(C)C)C
InChI=1SC22H23N3O5Sc114(2)2416(4)15(3)20(31(2930)198657919)21(24)2322(26)17101218(131117)25(27)28h514H14H3(H2326)
MFCD12204445
N(1isopropyl45dimethyl3(phenylsulfonyl)1Hpyrrol2yl)4nitrobenzamide
N(3(benzenesulfonyl)45dimethyl1propan2ylpyrrol2yl)4nitrobenzamide
N(45dimethyl3(phenylsulfonyl)1(propan2yl)1Hpyrrol2yl)4nitrobenzamide
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1n(C(C)C)c(c(c1S(=O)(=O)c1ccccc1)C)C
ZINC000012408988
ZINC12408988
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