Vitas-M small molecule compound
5-(3-chloro-4-methylphenyl)-N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide
Catalog ID
STK397665
SMILES S=C(Nc1cc(ccc1O)[N+](=O)[O-])NC(=O)c1ccc(o1)c1ccc(c(c1)Cl)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 C19H14ClN3O5S MW 431.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN3O5S/c1-10-2-3-11(8-13(10)20)16-6-7-17(28-16)18(25)22-19(29)21-14-9-12(23(26)27)4-5-15(14)24/h2-9,24H,1H3,(H2,21,22,25,29)InChIKey
VVKZUACWGNCCCI-UHFFFAOYSA-NSynonyms
5(3chloro4methylphenyl)N((2hydroxy5nitrophenyl)carbamothioyl)furan2carboxamide
CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=CC(=C3)(N+)(=O)(O))O)Cl
InChI=1SC19H14ClN3O5Sc1102311(813(10)20)166717(2816)18(25)2219(29)2114912(23(26)27)4515(14)24h2924H1H3(H221222529)
MFCD05848836
S=C(Nc1cc(ccc1O)(N+)(=O)(O))NC(=O)c1ccc(o1)c1ccc(c(c1)Cl)C
ZINC000035933609
ZINC35933609
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