Vitas-M small molecule compound
N-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl}-4-nitrobenzamide
Catalog ID
STK248648
SMILES S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1)c1nc2c(s1)cc(cc2)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 C22H16N4O3S2 MW 448.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O3S2/c1-13-2-11-18-19(12-13)31-21(24-18)15-3-7-16(8-4-15)23-22(30)25-20(27)14-5-9-17(10-6-14)26(28)29/h2-12H,1H3,(H2,23,25,27,30)InChIKey
LQUGKVQJWHJVNQ-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC22H16N4O3S2c1132111819(1213)3121(2418)153716(8415)2322(30)2520(27)145917(10614)26(28)29h212H1H3(H223252730)
MFCD02221928
N((4(6methyl13benzothiazol2yl)phenyl)carbamothioyl)4nitrobenzamide
S=C(NC(=O)c1ccc(cc1)(N+)(=O)(O))Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C
ZINC000002973325
ZINC02973325
ZINC2973325
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