Vitas-M small molecule compound
N-[(5-tert-butyl-3-chloro-2-hydroxyphenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide
Catalog ID
STK412228
SMILES S=C(Nc1cc(cc(c1O)Cl)C(C)(C)C)NC(=O)c1ccc(o1)c1cccc(c1)[N+](=O)[O-]
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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 C22H20ClN3O5S MW 473.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O5S/c1-22(2,3)13-10-15(23)19(27)16(11-13)24-21(32)25-20(28)18-8-7-17(31-18)12-5-4-6-14(9-12)26(29)30/h4-11,27H,1-3H3,(H2,24,25,28,32)InChIKey
AOFPREOKYKCGJF-UHFFFAOYSA-NSynonyms
CC(C)(C)C1=CC(=C(C(=C1)Cl)O)NC(=S)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC22H20ClN3O5Sc122(23)131015(23)19(27)16(1113)2421(32)2520(28)188717(3118)1254614(912)26(29)30h41127H13H3(H224252832)
MFCD05831036
N((5tertbutyl3chloro2hydroxyphenyl)carbamothioyl)5(3nitrophenyl)furan2carboxamide
S=C(Nc1cc(cc(c1O)Cl)C(C)(C)C)NC(=O)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
ZINC000002874721
ZINC02874721
ZINC2874721
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