Vitas-M small molecule compound
3-iodo-4-methoxy-N-[(2-methyl-3-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK123178
SMILES COc1ccc(cc1I)C(=O)NC(=S)Nc1cccc(c1C)[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 C16H14IN3O4S MW 471.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14IN3O4S/c1-9-12(4-3-5-13(9)20(22)23)18-16(25)19-15(21)10-6-7-14(24-2)11(17)8-10/h3-8H,1-2H3,(H2,18,19,21,25)InChIKey
BYSDDWCBMGRNDA-UHFFFAOYSA-NSynonyms
3IODO4METHOXYN((2METHYL3NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=C(C=CC=C1(N+)(=O)(O))NC(=S)NC(=O)C2=CC(=C(C=C2)OC)I
COc1ccc(cc1I)C(=O)NC(=S)Nc1cccc(c1C)(N+)(=O)(O)
InChI=1SC16H14IN3O4Sc1912(43513(9)20(22)23)1816(25)1915(21)106714(242)11(17)810h38H12H3(H218192125)
MFCD03587910
ZINC000001127819
ZINC01127819
ZINC1127819
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