Vitas-M small molecule compound
N-{[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-4-nitrobenzamide
Catalog ID
STK098286
SMILES S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1ccc2c(c1)nc(o2)c1ccccc1Br
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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 C21H13BrN4O4S MW 497.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrN4O4S/c22-16-4-2-1-3-15(16)20-24-17-11-13(7-10-18(17)30-20)23-21(31)25-19(27)12-5-8-14(9-6-12)26(28)29/h1-11H,(H2,23,25,27,31)InChIKey
PSWPEPYPWOVPEU-UHFFFAOYSA-NSynonyms
C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O))Br
InChI=1SC21H13BrN4O4Sc2216421315(16)2024171113(71018(17)3020)2321(31)2519(27)125814(9612)26(28)29h111H(H223252731)
MFCD02624960
N((2(2BROMOPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)4NITROBENZAMIDE
S=C(NC(=O)c1ccc(cc1)(N+)(=O)(O))Nc1ccc2c(c1)nc(o2)c1ccccc1Br
STK098286
ZINC000001180360
ZINC01180360
ZINC1180360
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