Vitas-M small molecule compound
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-methyl-3-nitrobenzamide
Catalog ID
STK236695
SMILES Cc1cc(ccc1NC(=O)c1cccc(c1C)[N+](=O)[O-])c1nc2c(s1)cccc2
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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 C22H17N3O3S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O3S/c1-13-12-15(22-24-18-7-3-4-9-20(18)29-22)10-11-17(13)23-21(26)16-6-5-8-19(14(16)2)25(27)28/h3-12H,1-2H3,(H,23,26)InChIKey
YDJDDTWLARYGGX-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4=C(C(=CC=C4)(N+)(=O)(O))C
Cc1cc(ccc1NC(=O)c1cccc(c1C)(N+)(=O)(O))c1nc2c(s1)cccc2
InChI=1SC22H17N3O3Sc1131215(222418734920(18)2922)101117(13)2321(26)1665819(14(16)2)25(27)28h312H12H3(H2326)
MFCD08575354
N(4(13benzothiazol2yl)2methylphenyl)2methyl3nitrobenzamide
ZINC000009190316
ZINC09190316
ZINC9190316
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