Vitas-M small molecule compound
N-[(2-ethyl-4-iodophenyl)carbamothioyl]-4-methoxy-3-nitrobenzamide
Catalog ID
STK255249
SMILES CCc1cc(I)ccc1NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC
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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 C17H16IN3O4S MW 485.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16IN3O4S/c1-3-10-8-12(18)5-6-13(10)19-17(26)20-16(22)11-4-7-15(25-2)14(9-11)21(23)24/h4-9H,3H2,1-2H3,(H2,19,20,22,26)InChIKey
OXLLHCZAMCHRPT-UHFFFAOYSA-NSynonyms
CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O)
CCc1cc(I)ccc1NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC17H16IN3O4Sc1310812(18)5613(10)1917(26)2016(22)114715(252)14(911)21(23)24h49H3H212H3(H219202226)
MFCD04079009
N((2ethyl4iodophenyl)carbamothioyl)4methoxy3nitrobenzamide
ZINC000009355138
ZINC09355138
ZINC9355138
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