Vitas-M small molecule compound
(4-ethylpiperazin-1-yl)(3-nitrophenyl)methanethione
Catalog ID
STL436452
SMILES CCN1CCN(CC1)C(=S)c1cccc(c1)[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 C13H17N3O2S MW 279.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O2S/c1-2-14-6-8-15(9-7-14)13(19)11-4-3-5-12(10-11)16(17)18/h3-5,10H,2,6-9H2,1H3InChIKey
RQDLZJHPQNQATH-UHFFFAOYSA-NSynonyms
(4ethylpiperazin1yl)(3nitrophenyl)methanethione
CCN1CCN(CC1)C(=S)c1cccc(c1)(N+)(=O)(O)
CCN1CCN(CC1)C(=S)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC13H17N3O2Sc12146815(9714)13(19)1143512(1011)16(17)18h3510H269H21H3
MFCD05990352
ZINC000055539430
ZINC55539430
Check stock
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Check stock on Vitas-MAvailable files
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