Vitas-M small molecule compound
N-[(4-iodo-2,5-dimethylphenyl)carbamothioyl]-4-methoxy-3-nitrobenzamide
Catalog ID
STK345656
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(C)c(cc1C)I
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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/c1-9-7-13(10(2)6-12(9)18)19-17(26)20-16(22)11-4-5-15(25-3)14(8-11)21(23)24/h4-8H,1-3H3,(H2,19,20,22,26)InChIKey
SFVLQPUNYNSDDT-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1I)C)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cc(C)c(cc1C)I
InChI=1SC17H16IN3O4Sc19713(10(2)612(9)18)1917(26)2016(22)114515(253)14(811)21(23)24h48H13H3(H219202226)
MFCD04356902
N((4iodo25dimethylphenyl)carbamothioyl)4methoxy3nitrobenzamide
ZINC000002858031
ZINC02858031
ZINC2858031
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