Vitas-M small molecule compound
1-(4-methylphenyl)-1H-tetrazol-5-yl (1Z)-N-(4-nitrophenyl)-2-oxopropanehydrazonothioate
Catalog ID
STK538019
SMILES Cc1ccc(cc1)n1nnnc1S/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/C(=O)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 C17H15N7O3S MW 397.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N7O3S/c1-11-3-7-14(8-4-11)23-17(20-21-22-23)28-16(12(2)25)19-18-13-5-9-15(10-6-13)24(26)27/h3-10,18H,1-2H3/b19-16-InChIKey
NHGPPXBNKDFONQ-MNDPQUGUSA-NSynonyms
(1(4METHYLPHENYL)TETRAZOL5YL)(1Z)N(4NITROANILINO)2OXOPROPANIMIDOTHIOATE
(Z)1(ptolyl)1Htetrazol5ylN(4nitrophenyl)2oxopropanehydrazonothioate
1(4methylphenyl)1Htetrazol5yl(1Z)N(4nitrophenyl)2oxopropanehydrazonothioate
CC1=CC=C(C=C1)N2C(=NN=N2)SC(=NNC3=CC=C(C=C3)(N+)(=O)(O))C(=O)C
Cc1ccc(cc1)n1nnnc1SC(=NNc1ccc(cc1)(N+)(=O)(O))C(=O)C
InChI=1SC17H15N7O3Sc1113714(8411)2317(20212223)2816(12(2)25)1918135915(10613)24(26)27h31018H12H3b1916
MFCD02985621
ZINC000009066235
ZINC102422248
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