Vitas-M small molecule compound
2-(4-tert-butylphenoxy)-N-[(4-fluoro-3-nitrophenyl)carbamothioyl]acetamide
Catalog ID
STK155801
SMILES O=C(NC(=S)Nc1ccc(c(c1)[N+](=O)[O-])F)COc1ccc(cc1)C(C)(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 C19H20FN3O4S MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN3O4S/c1-19(2,3)12-4-7-14(8-5-12)27-11-17(24)22-18(28)21-13-6-9-15(20)16(10-13)23(25)26/h4-10H,11H2,1-3H3,(H2,21,22,24,28)InChIKey
KWSOUCWYQRVVHU-UHFFFAOYSA-NSynonyms
425652-34-22(4TERTBUTYLPHENOXY)N((4FLUORO3NITROPHENYL)CARBAMOTHIOYL)ACETAMIDE
425652342
CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)F)(N+)(=O)(O)
InChI=1SC19H20FN3O4Sc119(23)124714(8512)271117(24)2218(28)21136915(20)16(1013)23(25)26h410H11H213H3(H221222428)
MFCD02799387
O=C(NC(=S)Nc1ccc(c(c1)(N+)(=O)(O))F)COc1ccc(cc1)C(C)(C)C
ZINC000001185765
ZINC01185765
ZINC1185765
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