Vitas-M small molecule compound
2-methyl-3-nitro-N-{4-[(propanoylcarbamothioyl)amino]phenyl}benzamide
Catalog ID
STK133352
SMILES CCC(=O)NC(=S)Nc1ccc(cc1)NC(=O)c1cccc(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 C18H18N4O4S MW 386.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O4S/c1-3-16(23)21-18(27)20-13-9-7-12(8-10-13)19-17(24)14-5-4-6-15(11(14)2)22(25)26/h4-10H,3H2,1-2H3,(H,19,24)(H2,20,21,23,27)InChIKey
KSBSEHKCZSRISC-UHFFFAOYSA-NSynonyms
2METHYL3NITRON(4(((PROPIONYLAMINO)CARBONOTHIOYL)AMINO)PHENYL)BENZAMIDE
2METHYL3NITRON(4((PROPANOYLCARBAMOTHIOYL)AMINO)PHENYL)BENZAMIDE
2METHYL3NITRON(4(PROPANOYLCARBAMOTHIOYLAMINO)PHENYL)BENZAMIDE
CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=C(C(=CC=C2)(N+)(=O)(O))C
CCC(=O)NC(=S)Nc1ccc(cc1)NC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC18H18N4O4Sc1316(23)2118(27)20139712(81013)1917(24)1454615(11(14)2)22(25)26h410H3H212H3(H1924)(H220212327)
MFCD03564661
ZINC000001130205
ZINC01130205
ZINC1130205
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