Vitas-M small molecule compound
N-{[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-methyl-3-nitrobenzamide
Catalog ID
STK173239
SMILES S=C(NC(=O)c1cccc(c1C)[N+](=O)[O-])Nc1cccc(c1)c1nc2c(o1)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 C22H16N4O4S MW 432.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O4S/c1-13-16(8-5-10-18(13)26(28)29)20(27)25-22(31)23-15-7-4-6-14(12-15)21-24-17-9-2-3-11-19(17)30-21/h2-12H,1H3,(H2,23,25,27,31)InChIKey
WJYONTKNTFNRHI-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3
InChI=1SC22H16N4O4Sc11316(851018(13)26(28)29)20(27)2522(31)231574614(1215)2124179231119(17)3021h212H1H3(H223252731)
MFCD02923682
N((3(13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)2METHYL3NITROBENZAMIDE
S=C(NC(=O)c1cccc(c1C)(N+)(=O)(O))Nc1cccc(c1)c1nc2c(o1)cccc2
ZINC000001183374
ZINC01183374
ZINC1183374
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